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

Systemtic Name: 3-(5-oxidanylidene-4-phenyl-1,2,3,4-tetrazol-1-yl)-N-[phenyl(thiophen-2-yl)methyl]propanamide Openeye Name: 3-(5-oxo-4-phenyl-tetrazol-1-yl)-N-[phenyl(2-thienyl)methyl]propanamide CAS Name: 3-(5-oxo-4-phenyl-1-tetrazolyl)-N-[phenyl(thiophen-2-yl)methyl]propanamide IUPAC Name: 3-(5-oxo-4-phenyltetrazol-1-yl)-N-[phenyl(thiophen-2-yl)methyl]propanamide Traditional Name: 3-(5-keto-4-phenyl-tetrazol-1-yl)-N-[phenyl(2-thienyl)methyl]propionamide Formula: C21H19N5O2S MolecularWeight: 405.47286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CCN3C(=O)N(N=N3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CCN3C(=O)N(N=N3)C4=CC=CC=C4

InChI

InChI=1S/C21H19N5O2S/c27-19(22-20(18-12-7-15-29-18)16-8-3-1-4-9-16)13-14-25-21(28)26(24-23-25)17-10-5-2-6-11-17/h1-12,15,20H,13-14H2,(H,22,27)