O2-[2-[(3-aminocarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl] O4-propan-2-yl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-[2-[(3-aminocarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl] O4-propan-2-yl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[2-[(3-carbamoyl-2-thienyl)amino]-2-oxo-ethyl] O4-isopropyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-[(3-carbamoyl-2-thiophenyl)amino]-2-oxoethyl] ester O4-propan-2-yl ester IUPAC Name: 2-O-[2-[(3-carbamoylthiophen-2-yl)amino]-2-oxoethyl] 4-O-propan-2-yl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-[(3-carbamoyl-2-thienyl)amino]-2-keto-ethyl] ester O4-isopropyl ester Formula: C18H21N3O6S MolecularWeight: 407.44084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)OCC(=O)NC2=C(C=CS2)C(=O)N

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)OCC(=O)NC2=C(C=CS2)C(=O)N

InChI

InChI=1S/C18H21N3O6S/c1-8(2)27-17(24)13-9(3)14(20-10(13)4)18(25)26-7-12(22)21-16-11(15(19)23)5-6-28-16/h5-6,8,20H,7H2,1-4H3,(H2,19,23)(H,21,22)