ethyl 2-[[4-(4-methylpiperidin-1-yl)-3-(pyridin-3-ylmethylcarbamoyl)phenyl]carbamoylamino]ethanoate

Systemtic Name: ethyl 2-[[4-(4-methylpiperidin-1-yl)-3-(pyridin-3-ylmethylcarbamoyl)phenyl]carbamoylamino]ethanoate Openeye Name: ethyl 2-[[4-(4-methyl-1-piperidyl)-3-(3-pyridylmethylcarbamoyl)phenyl]carbamoylamino]acetate CAS Name: 2-[[[4-(4-methyl-1-piperidinyl)-3-[oxo-(3-pyridinylmethylamino)methyl]anilino]-oxomethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[4-(4-methylpiperidin-1-yl)-3-(pyridin-3-ylmethylcarbamoyl)phenyl]carbamoylamino]acetate Traditional Name: 2-[[4-(4-methylpiperidino)-3-(3-pyridylmethylcarbamoyl)phenyl]carbamoylamino]acetic acid ethyl ester Formula: C24H31N5O4 MolecularWeight: 453.53404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)NC1=CC(=C(C=C1)N2CCC(CC2)C)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

CCOC(=O)CNC(=O)NC1=CC(=C(C=C1)N2CCC(CC2)C)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C24H31N5O4/c1-3-33-22(30)16-27-24(32)28-19-6-7-21(29-11-8-17(2)9-12-29)20(13-19)23(31)26-15-18-5-4-10-25-14-18/h4-7,10,13-14,17H,3,8-9,11-12,15-16H2,1-2H3,(H,26,31)(H2,27,28,32)