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

Systemtic Name: N-(3-methyl-4-pyrrolidin-1-yl-phenyl)-2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanamide Openeye Name: N-(3-methyl-4-pyrrolidin-1-yl-phenyl)-2-(5-phenyltetrazol-2-yl)acetamide CAS Name: N-[3-methyl-4-(1-pyrrolidinyl)phenyl]-2-(5-phenyl-2-tetrazolyl)acetamide IUPAC Name: N-(3-methyl-4-pyrrolidin-1-ylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide Traditional Name: N-(3-methyl-4-pyrrolidino-phenyl)-2-(5-phenyltetrazol-2-yl)acetamide Formula: C20H22N6O MolecularWeight: 362.42828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CN2N=C(N=N2)C3=CC=CC=C3)N4CCCC4

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CN2N=C(N=N2)C3=CC=CC=C3)N4CCCC4

InChI

InChI=1S/C20H22N6O/c1-15-13-17(9-10-18(15)25-11-5-6-12-25)21-19(27)14-26-23-20(22-24-26)16-7-3-2-4-8-16/h2-4,7-10,13H,5-6,11-12,14H2,1H3,(H,21,27)