N-[4-[2-[(5-indol-2-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]phenyl]hexanamide

Systemtic Name: N-[4-[2-[(5-indol-2-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]phenyl]hexanamide Openeye Name: N-[4-[2-[(5-indol-2-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]hexanamide CAS Name: N-[4-[2-[[5-(2-indolylidene)-4-phenyl-1H-1,2,4-triazol-3-yl]thio]-1-oxoethyl]phenyl]hexanamide IUPAC Name: N-[4-[2-[(5-indol-2-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]hexanamide Traditional Name: N-[4-[2-[(5-indol-2-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl)thio]acetyl]phenyl]hexanamide Formula: C30H29N5O2S MolecularWeight: 523.64856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NNC(=C3C=C4C=CC=CC4=N3)N2C5=CC=CC=C5

Isomeric SMILES

CCCCCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NNC(=C3C=C4C=CC=CC4=N3)N2C5=CC=CC=C5

InChI

InChI=1S/C30H29N5O2S/c1-2-3-5-14-28(37)31-23-17-15-21(16-18-23)27(36)20-38-30-34-33-29(35(30)24-11-6-4-7-12-24)26-19-22-10-8-9-13-25(22)32-26/h4,6-13,15-19,33H,2-3,5,14,20H2,1H3,(H,31,37)