5-[(3-cyanophenyl)carbamoylamino]-N-(1-phenylethyl)-2-piperidin-1-yl-benzamide

Systemtic Name: 5-[(3-cyanophenyl)carbamoylamino]-N-(1-phenylethyl)-2-piperidin-1-yl-benzamide Openeye Name: 5-[(3-cyanophenyl)carbamoylamino]-N-(1-phenylethyl)-2-(1-piperidyl)benzamide CAS Name: 5-[[(3-cyanoanilino)-oxomethyl]amino]-N-(1-phenylethyl)-2-(1-piperidinyl)benzamide IUPAC Name: 5-[(3-cyanophenyl)carbamoylamino]-N-(1-phenylethyl)-2-piperidin-1-ylbenzamide Traditional Name: 5-[(3-cyanophenyl)carbamoylamino]-N-(1-phenylethyl)-2-piperidino-benzamide Formula: C28H29N5O2 MolecularWeight: 467.56216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=C(C=CC(=C2)NC(=O)NC3=CC=CC(=C3)C#N)N4CCCCC4

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=C(C=CC(=C2)NC(=O)NC3=CC=CC(=C3)C#N)N4CCCCC4

InChI

InChI=1S/C28H29N5O2/c1-20(22-10-4-2-5-11-22)30-27(34)25-18-24(13-14-26(25)33-15-6-3-7-16-33)32-28(35)31-23-12-8-9-21(17-23)19-29/h2,4-5,8-14,17-18,20H,3,6-7,15-16H2,1H3,(H,30,34)(H2,31,32,35)