N-(cyclohexylmethyl)-2-[[(5Z)-5-indol-3-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(cyclohexylmethyl)-2-[[(5Z)-5-indol-3-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(cyclohexylmethyl)-2-[[(5Z)-5-indol-3-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(cyclohexylmethyl)-2-[[(5Z)-5-(3-indolylidene)-4-phenyl-1H-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(cyclohexylmethyl)-2-[[(5Z)-5-indol-3-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(cyclohexylmethyl)-2-[[(5Z)-5-indol-3-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C25H27N5OS MolecularWeight: 445.57978

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)CSC2=NNC(=C3C=NC4=CC=CC=C43)N2C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)CNC(=O)CSC2=NN/C(=C/3\C=NC4=CC=CC=C43)/N2C5=CC=CC=C5

InChI

InChI=1S/C25H27N5OS/c31-23(27-15-18-9-3-1-4-10-18)17-32-25-29-28-24(30(25)19-11-5-2-6-12-19)21-16-26-22-14-8-7-13-20(21)22/h2,5-8,11-14,16,18,28H,1,3-4,9-10,15,17H2,(H,27,31)/b24-21-