2-allyl-5-methyl-3-thioxo-2,3,5,6,11,11a-hexahydro-1H-imidazo[5',1':6,1]pyrido[3,4-b]indol-1-one
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![2-allyl-5-methyl-3-thioxo-2,3,5,6,11,11a-hexahydro-1H-imidazo[5',1':6,1]pyrido[3,4-b]indol-1-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/82582ac45d1f4ed1a49d5438fad99ec4.png "2-allyl-5-methyl-3-thioxo-2,3,5,6,11,11a-hexahydro-1H-imidazo[5',1':6,1]pyrido[3,4-b]indol-1-one")
2-allyl-5-methyl-3-thioxo-2,3,5,6,11,11a-hexahydro-1H-imidazo[5',1':6,1]pyrido[3,4-b]indol-1-one
structure -
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CAS No:
449797-06-2
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Formula:
C17H17N3OS
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Chemical Name:
2-allyl-5-methyl-3-thioxo-2,3,5,6,11,11a-hexahydro-1H-imidazo[5',1':6,1]pyrido[3,4-b]indol-1-one
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Synonyms:
2-allyl-5-methyl-3-thioxo-2,3,5,6,11,11a-hexahydro-1H-imidazo[5",1":6,1]pyrido[3,4-b]indol-1-one;HMS1595K03;STL512243;AKOS003658087;AKOS022143247;CCG-327873;MCULE-9385680755;AQ-090/41728912;SR-01000289080;SR-01000289080-1
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CAS No:
2-allyl-5-methyl-3-thioxo-2,3,5,6,11,11a-hexahydro-1H-imidazo[5',1':6,1]pyrido[3,4-b]indol-1-one Basic Attributes
311.40138
311.109
Computed Properties
Molecular Weight:311.4
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:311.10923335
Monoisotopic Mass:311.10923335
Topological Polar Surface Area:71.4
Heavy Atom Count:22
Complexity:522
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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