methyl 2-(2-azanylethylcarbamoyl)-4-[(3-methylphenyl)carbamoyl]piperazine-1-carboxylate

Systemtic Name: methyl 2-(2-azanylethylcarbamoyl)-4-[(3-methylphenyl)carbamoyl]piperazine-1-carboxylate Openeye Name: methyl 2-(2-aminoethylcarbamoyl)-4-(m-tolylcarbamoyl)piperazine-1-carboxylate CAS Name: 2-[(2-aminoethylamino)-oxomethyl]-4-[(3-methylanilino)-oxomethyl]-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 2-(2-aminoethylcarbamoyl)-4-[(3-methylphenyl)carbamoyl]piperazine-1-carboxylate Traditional Name: 2-(2-aminoethylcarbamoyl)-4-(m-tolylcarbamoyl)piperazine-1-carboxylic acid methyl ester Formula: C17H25N5O4 MolecularWeight: 363.4115

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N2CCN(C(C2)C(=O)NCCN)C(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N2CCN(C(C2)C(=O)NCCN)C(=O)OC

InChI

InChI=1S/C17H25N5O4/c1-12-4-3-5-13(10-12)20-16(24)21-8-9-22(17(25)26-2)14(11-21)15(23)19-7-6-18/h3-5,10,14H,6-9,11,18H2,1-2H3,(H,19,23)(H,20,24)