N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanamide

Systemtic Name: N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanamide Openeye Name: N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-2-[5-oxo-4-(2-thienyl)tetrazol-1-yl]acetamide CAS Name: N-[2-methyl-4-(1-pyrrolidinyl)phenyl]-2-(5-oxo-4-thiophen-2-yl-1-tetrazolyl)acetamide IUPAC Name: N-(2-methyl-4-pyrrolidin-1-ylphenyl)-2-(5-oxo-4-thiophen-2-yltetrazol-1-yl)acetamide Traditional Name: 2-[5-keto-4-(2-thienyl)tetrazol-1-yl]-N-(2-methyl-4-pyrrolidino-phenyl)acetamide Formula: C18H20N6O2S MolecularWeight: 384.4554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)CN3C(=O)N(N=N3)C4=CC=CS4

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)CN3C(=O)N(N=N3)C4=CC=CS4

InChI

InChI=1S/C18H20N6O2S/c1-13-11-14(22-8-2-3-9-22)6-7-15(13)19-16(25)12-23-18(26)24(21-20-23)17-5-4-10-27-17/h4-7,10-11H,2-3,8-9,12H2,1H3,(H,19,25)