5-[(3,4-dimethylphenyl)carbamoylamino]-2-piperidin-1-yl-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 5-[(3,4-dimethylphenyl)carbamoylamino]-2-piperidin-1-yl-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 5-[(3,4-dimethylphenyl)carbamoylamino]-2-(1-piperidyl)-N-(3-pyridylmethyl)benzamide CAS Name: 5-[[(3,4-dimethylanilino)-oxomethyl]amino]-2-(1-piperidinyl)-N-(3-pyridinylmethyl)benzamide IUPAC Name: 5-[(3,4-dimethylphenyl)carbamoylamino]-2-piperidin-1-yl-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 5-[(3,4-dimethylphenyl)carbamoylamino]-2-piperidino-N-(3-pyridylmethyl)benzamide Formula: C27H31N5O2 MolecularWeight: 457.56734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC2=CC(=C(C=C2)N3CCCCC3)C(=O)NCC4=CN=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC2=CC(=C(C=C2)N3CCCCC3)C(=O)NCC4=CN=CC=C4)C

InChI

InChI=1S/C27H31N5O2/c1-19-8-9-22(15-20(19)2)30-27(34)31-23-10-11-25(32-13-4-3-5-14-32)24(16-23)26(33)29-18-21-7-6-12-28-17-21/h6-12,15-17H,3-5,13-14,18H2,1-2H3,(H,29,33)(H2,30,31,34)