4-(1-carbamimidoylpyrrolidin-2-yl)-N-[1-(4-methylphenyl)ethyl]benzamide hydrochloride

Systemtic Name: 4-(1-carbamimidoylpyrrolidin-2-yl)-N-[1-(4-methylphenyl)ethyl]benzamide hydrochloride Openeye Name: 4-(1-carbamimidoylpyrrolidin-2-yl)-N-[1-(p-tolyl)ethyl]benzamide hydrochloride CAS Name: 4-(1-carbamimidoyl-2-pyrrolidinyl)-N-[1-(4-methylphenyl)ethyl]benzamide hydrochloride IUPAC Name: 4-(1-carbamimidoylpyrrolidin-2-yl)-N-[1-(4-methylphenyl)ethyl]benzamide hydrochloride Traditional Name: 4-(1-amidinopyrrolidin-2-yl)-N-[1-(p-tolyl)ethyl]benzamide hydrochloride Formula: C21H27ClN4O MolecularWeight: 386.91828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C)NC(=O)C2=CC=C(C=C2)C3CCCN3C(=N)N.Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(C)NC(=O)C2=CC=C(C=C2)C3CCCN3C(=N)N.Cl

InChI

InChI=1S/C21H26N4O.ClH/c1-14-5-7-16(8-6-14)15(2)24-20(26)18-11-9-17(10-12-18)19-4-3-13-25(19)21(22)23;/h5-12,15,19H,3-4,13H2,1-2H3,(H3,22,23)(H,24,26);1H