N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-indol-3-ylidene-4-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-indol-3-ylidene-4-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-indol-3-ylidene-4-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[5-(3-indolylidene)-4-methyl-1H-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-indol-3-ylidene-4-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(5-indol-3-ylidene-4-methyl-1H-1,2,4-triazol-3-yl)thio]-N-piperonyl-acetamide Formula: C21H19N5O3S MolecularWeight: 421.47226

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C2C=NC3=CC=CC=C32)NN=C1SCC(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN1C(=C2C=NC3=CC=CC=C32)NN=C1SCC(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H19N5O3S/c1-26-20(15-10-22-16-5-3-2-4-14(15)16)24-25-21(26)30-11-19(27)23-9-13-6-7-17-18(8-13)29-12-28-17/h2-8,10,24H,9,11-12H2,1H3,(H,23,27)