(phenylmethyl) 2-[ethyl-(4-indol-1-ylpyrimidin-2-yl)amino]-4-(naphthalen-1-ylcarbamoyl)piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[ethyl-(4-indol-1-ylpyrimidin-2-yl)amino]-4-(naphthalen-1-ylcarbamoyl)piperazine-1-carboxylate Openeye Name: benzyl 2-[ethyl-(4-indol-1-ylpyrimidin-2-yl)amino]-4-(1-naphthylcarbamoyl)piperazine-1-carboxylate CAS Name: 2-[ethyl-[4-(1-indolyl)-2-pyrimidinyl]amino]-4-[(1-naphthalenylamino)-oxomethyl]-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[ethyl-(4-indol-1-ylpyrimidin-2-yl)amino]-4-(naphthalen-1-ylcarbamoyl)piperazine-1-carboxylate Traditional Name: 2-[ethyl-(4-indol-1-ylpyrimidin-2-yl)amino]-4-(1-naphthylcarbamoyl)piperazine-1-carboxylic acid benzyl ester Formula: C37H35N7O3 MolecularWeight: 625.7189

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CN(CCN1C(=O)OCC2=CC=CC=C2)C(=O)NC3=CC=CC4=CC=CC=C43)C5=NC=CC(=N5)N6C=CC7=CC=CC=C76

Isomeric SMILES

CCN(C1CN(CCN1C(=O)OCC2=CC=CC=C2)C(=O)NC3=CC=CC4=CC=CC=C43)C5=NC=CC(=N5)N6C=CC7=CC=CC=C76

InChI

InChI=1S/C37H35N7O3/c1-2-42(35-38-21-19-33(40-35)43-22-20-29-14-7-9-18-32(29)43)34-25-41(23-24-44(34)37(46)47-26-27-11-4-3-5-12-27)36(45)39-31-17-10-15-28-13-6-8-16-30(28)31/h3-22,34H,2,23-26H2,1H3,(H,39,45)