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

Systemtic Name: N,N-bis(2-cyanoethyl)-2-[[(5Z)-4-cyclopropyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N,N-bis(2-cyanoethyl)-2-[[(5Z)-4-cyclopropyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N,N-bis(2-cyanoethyl)-2-[[(5Z)-4-cyclopropyl-5-(3-indolylidene)-1H-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N,N-bis(2-cyanoethyl)-2-[[(5Z)-4-cyclopropyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N,N-bis(2-cyanoethyl)-2-[[(5Z)-4-cyclopropyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C21H21N7OS MolecularWeight: 419.50274

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=C3C=NC4=CC=CC=C43)NN=C2SCC(=O)N(CCC#N)CCC#N

Isomeric SMILES

C1CC1N2/C(=C\3/C=NC4=CC=CC=C43)/NN=C2SCC(=O)N(CCC#N)CCC#N

InChI

InChI=1S/C21H21N7OS/c22-9-3-11-27(12-4-10-23)19(29)14-30-21-26-25-20(28(21)15-7-8-15)17-13-24-18-6-2-1-5-16(17)18/h1-2,5-6,13,15,25H,3-4,7-8,11-12,14H2/b20-17-