methyl 1-[[2-azanyl-4-ethoxycarbonyl-5-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrol-3-yl]carbonylamino]-2,5-dimethyl-4-(phenylcarbamoyl)pyrrole-3-carboxylate

Systemtic Name: methyl 1-[[2-azanyl-4-ethoxycarbonyl-5-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrol-3-yl]carbonylamino]-2,5-dimethyl-4-(phenylcarbamoyl)pyrrole-3-carboxylate Openeye Name: methyl 1-[[2-amino-1-(tert-butoxycarbonylamino)-4-ethoxycarbonyl-5-methyl-pyrrole-3-carbonyl]amino]-2,5-dimethyl-4-(phenylcarbamoyl)pyrrole-3-carboxylate CAS Name: 1-[[[2-amino-4-ethoxycarbonyl-5-methyl-1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-pyrrolyl]-oxomethyl]amino]-4-[anilino(oxo)methyl]-2,5-dimethyl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-[[2-amino-4-ethoxycarbonyl-5-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrole-3-carbonyl]amino]-2,5-dimethyl-4-(phenylcarbamoyl)pyrrole-3-carboxylate Traditional Name: 1-[[2-amino-1-(tert-butoxycarbonylamino)-4-carbethoxy-5-methyl-pyrrole-3-carbonyl]amino]-2,5-dimethyl-4-(phenylcarbamoyl)pyrrole-3-carboxylic acid methyl ester Formula: C29H36N6O8 MolecularWeight: 596.63154

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1C(=O)NN2C(=C(C(=C2C)C(=O)OC)C(=O)NC3=CC=CC=C3)C)N)NC(=O)OC(C)(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1C(=O)NN2C(=C(C(=C2C)C(=O)OC)C(=O)NC3=CC=CC=C3)C)N)NC(=O)OC(C)(C)C)C

InChI

InChI=1S/C29H36N6O8/c1-9-42-27(39)21-17(4)35(33-28(40)43-29(5,6)7)23(30)22(21)25(37)32-34-15(2)19(20(16(34)3)26(38)41-8)24(36)31-18-13-11-10-12-14-18/h10-14H,9,30H2,1-8H3,(H,31,36)(H,32,37)(H,33,40)