1-(phenylmethyl)-3-propan-2-ylsulfanyl-N-(2H-1,2,3,4-tetrazol-5-yl)indole-2-carboxamide

Systemtic Name: 1-(phenylmethyl)-3-propan-2-ylsulfanyl-N-(2H-1,2,3,4-tetrazol-5-yl)indole-2-carboxamide Openeye Name: 1-benzyl-3-isopropylsulfanyl-N-(2H-tetrazol-5-yl)indole-2-carboxamide CAS Name: 1-(phenylmethyl)-3-(propan-2-ylthio)-N-(2H-tetrazol-5-yl)-2-indolecarboxamide IUPAC Name: 1-benzyl-3-propan-2-ylsulfanyl-N-(2H-tetrazol-5-yl)indole-2-carboxamide Traditional Name: 1-benzyl-3-(isopropylthio)-N-(2H-tetrazol-5-yl)indole-2-carboxamide Formula: C20H20N6OS MolecularWeight: 392.4774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=C(N(C2=CC=CC=C21)CC3=CC=CC=C3)C(=O)NC4=NNN=N4

Isomeric SMILES

CC(C)SC1=C(N(C2=CC=CC=C21)CC3=CC=CC=C3)C(=O)NC4=NNN=N4

InChI

InChI=1S/C20H20N6OS/c1-13(2)28-18-15-10-6-7-11-16(15)26(12-14-8-4-3-5-9-14)17(18)19(27)21-20-22-24-25-23-20/h3-11,13H,12H2,1-2H3,(H2,21,22,23,24,25,27)