5-[(2-ethylphenyl)carbamoylamino]-2-piperidin-1-yl-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 5-[(2-ethylphenyl)carbamoylamino]-2-piperidin-1-yl-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 5-[(2-ethylphenyl)carbamoylamino]-2-(1-piperidyl)-N-(3-pyridylmethyl)benzamide CAS Name: 5-[[(2-ethylanilino)-oxomethyl]amino]-2-(1-piperidinyl)-N-(3-pyridinylmethyl)benzamide IUPAC Name: 5-[(2-ethylphenyl)carbamoylamino]-2-piperidin-1-yl-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 5-[(2-ethylphenyl)carbamoylamino]-2-piperidino-N-(3-pyridylmethyl)benzamide Formula: C27H31N5O2 MolecularWeight: 457.56734

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)NC2=CC(=C(C=C2)N3CCCCC3)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)NC2=CC(=C(C=C2)N3CCCCC3)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C27H31N5O2/c1-2-21-10-4-5-11-24(21)31-27(34)30-22-12-13-25(32-15-6-3-7-16-32)23(17-22)26(33)29-19-20-9-8-14-28-18-20/h4-5,8-14,17-18H,2-3,6-7,15-16,19H2,1H3,(H,29,33)(H2,30,31,34)