3-methyl-N-[4-[2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanoyl]phenyl]butanamide

Systemtic Name: 3-methyl-N-[4-[2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanoyl]phenyl]butanamide Openeye Name: 3-methyl-N-[4-[2-[5-oxo-4-(2-thienyl)tetrazol-1-yl]acetyl]phenyl]butanamide CAS Name: 3-methyl-N-[4-[1-oxo-2-(5-oxo-4-thiophen-2-yl-1-tetrazolyl)ethyl]phenyl]butanamide IUPAC Name: 3-methyl-N-[4-[2-(5-oxo-4-thiophen-2-yltetrazol-1-yl)acetyl]phenyl]butanamide Traditional Name: N-[4-[2-[5-keto-4-(2-thienyl)tetrazol-1-yl]acetyl]phenyl]-3-methyl-butyramide Formula: C18H19N5O3S MolecularWeight: 385.44016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)C(=O)CN2C(=O)N(N=N2)C3=CC=CS3

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)C(=O)CN2C(=O)N(N=N2)C3=CC=CS3

InChI

InChI=1S/C18H19N5O3S/c1-12(2)10-16(25)19-14-7-5-13(6-8-14)15(24)11-22-18(26)23(21-20-22)17-4-3-9-27-17/h3-9,12H,10-11H2,1-2H3,(H,19,25)