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Home > Encyclopedia > 2-[(5-(AMINOCARBONYL)-3-([3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE]METHYL)-2-CYCLOHEXEN-1-YLIDENE)METHYL]-3-ETHYL-1,3-BENZOTHIAZOL-3-IUM IODIDE

2-[(5-(AMINOCARBONYL)-3-([3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE]METHYL)-2-CYCLOHEXEN-1-YLIDENE)METHYL]-3-ETHYL-1,3-BENZOTHIAZOL-3-IUM IODIDE

2-[(5-(AMINOCARBONYL)-3-([3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE]METHYL)-2-CYCLOHEXEN-1-YLIDENE)METHYL]-3-ETHYL-1,3-BENZOTHIAZOL-3-IUM IODIDE structure

2-[(5-(AMINOCARBONYL)-3-([3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE]METHYL)-2-CYCLOHEXEN-1-YLIDENE)METHYL]-3-ETHYL-1,3-BENZOTHIAZOL-3-IUM IODIDE 

structure
  • CAS No:

    34719-10-3

  • Formula:

    C27H28IN3OS2

  • Chemical Name:

    2-[(5-(AMINOCARBONYL)-3-([3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE]METHYL)-2-CYCLOHEXEN-1-YLIDENE)METHYL]-3-ETHYL-1,3-BENZOTHIAZOL-3-IUM IODIDE

  • Synonyms:

    DTXSID20698327;AKOS000814149;2-({5-Carbamoyl-3-[(3-ethyl-1,3-benzothiazol-2(3H)-ylidene)methyl]cyclohex-2-en-1-ylidene}methyl)-3-ethyl-1,3-benzothiazol-3-ium iodide;2-[(5-(AMINOCARBONYL)-3-([3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE]METHYL)-2-CYCLOHEXEN-1-YLIDENE)METHYL]-3-ETHYL-1,3-BENZOTHIAZOL-3-IUM IODIDE

2-[(5-(AMINOCARBONYL)-3-([3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE]METHYL)-2-CYCLOHEXEN-1-YLIDENE)METHYL]-3-ETHYL-1,3-BENZOTHIAZOL-3-IUM IODIDE Basic Attributes

601.57

601.07185 g/mol

DTXSID20698327

Characteristics

104 Ų

2.91600

Computed Properties

Molecular Weight:601.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:601.07185
Monoisotopic Mass:601.07185
Topological Polar Surface Area:104
Heavy Atom Count:34
Complexity:779
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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