methyl 4-[[[4-[4-(4-methylcyclohexyl)piperazin-1-yl]phenyl]carbonylamino]carbamoyl]benzoate

Systemtic Name: methyl 4-[[[4-[4-(4-methylcyclohexyl)piperazin-1-yl]phenyl]carbonylamino]carbamoyl]benzoate Openeye Name: methyl 4-[[[4-[4-(4-methylcyclohexyl)piperazin-1-yl]benzoyl]amino]carbamoyl]benzoate CAS Name: 4-[[[[4-[4-(4-methylcyclohexyl)-1-piperazinyl]phenyl]-oxomethyl]hydrazo]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[4-[4-(4-methylcyclohexyl)piperazin-1-yl]benzoyl]amino]carbamoyl]benzoate Traditional Name: 4-[[[4-[4-(4-methylcyclohexyl)piperazino]benzoyl]amino]carbamoyl]benzoic acid methyl ester Formula: C27H34N4O4 MolecularWeight: 478.58326

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)N2CCN(CC2)C3=CC=C(C=C3)C(=O)NNC(=O)C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1CCC(CC1)N2CCN(CC2)C3=CC=C(C=C3)C(=O)NNC(=O)C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C27H34N4O4/c1-19-3-11-23(12-4-19)30-15-17-31(18-16-30)24-13-9-21(10-14-24)26(33)29-28-25(32)20-5-7-22(8-6-20)27(34)35-2/h5-10,13-14,19,23H,3-4,11-12,15-18H2,1-2H3,(H,28,32)(H,29,33)