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3-[[3-(1H-indol-3-yl)-4-(3-methylphenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methylamino]propanenitrile

3-[[3-(1H-indol-3-yl)-4-(3-methylphenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methylamino]propanenitrile structure

CAS No:
786717-22-4
Formula:
C22H22N6S
Chemical Name:
3-[[3-(1H-indol-3-yl)-4-(3-methylphenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methylamino]propanenitrile
Synonyms:
ZINC25703337;AKOS034337013;MCULE-7827969948;Z44101220;3-({[3-(1H-indol-3-yl)-4-(3-methylphenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-1-yl]methyl}(methyl)amino)propanenitrile;786717-22-4

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3-[[3-(1H-indol-3-yl)-4-(3-methylphenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methylamino]propanenitrile Basic Attributes

Molecular Weight：

402.5 g/mol

Exact Mass：

402.16266590 g/mol

Characteristics

PSA：

93.8 Å²

Computed Properties

Molecular Weight:402.5
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:402.16266590
Monoisotopic Mass:402.16266590
Topological Polar Surface Area:93.8
Heavy Atom Count:29
Complexity:684
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-[[3-(1H-indol-3-yl)-4-(3-methylphenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methylamino]propanenitrile

Basic Attributes
Characteristics
Computed Properties

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