5-[(4-cyanophenyl)carbamoylamino]-N-(1-phenylethyl)-2-pyrrolidin-1-yl-benzamide

Systemtic Name: 5-[(4-cyanophenyl)carbamoylamino]-N-(1-phenylethyl)-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-[(4-cyanophenyl)carbamoylamino]-N-(1-phenylethyl)-2-pyrrolidin-1-yl-benzamide CAS Name: 5-[[(4-cyanoanilino)-oxomethyl]amino]-N-(1-phenylethyl)-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-[(4-cyanophenyl)carbamoylamino]-N-(1-phenylethyl)-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-[(4-cyanophenyl)carbamoylamino]-N-(1-phenylethyl)-2-pyrrolidino-benzamide Formula: C27H27N5O2 MolecularWeight: 453.53558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=C(C=CC(=C2)NC(=O)NC3=CC=C(C=C3)C#N)N4CCCC4

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=C(C=CC(=C2)NC(=O)NC3=CC=C(C=C3)C#N)N4CCCC4

InChI

InChI=1S/C27H27N5O2/c1-19(21-7-3-2-4-8-21)29-26(33)24-17-23(13-14-25(24)32-15-5-6-16-32)31-27(34)30-22-11-9-20(18-28)10-12-22/h2-4,7-14,17,19H,5-6,15-16H2,1H3,(H,29,33)(H2,30,31,34)