ethyl 2-[1-[(2-methyl-3-nitro-phenyl)carbamoyl]piperidin-4-yl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[1-[(2-methyl-3-nitro-phenyl)carbamoyl]piperidin-4-yl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[1-[(2-methyl-3-nitro-phenyl)carbamoyl]-4-piperidyl]thiazole-4-carboxylate CAS Name: 2-[1-[(2-methyl-3-nitroanilino)-oxomethyl]-4-piperidinyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[1-[(2-methyl-3-nitrophenyl)carbamoyl]piperidin-4-yl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[1-[(2-methyl-3-nitro-phenyl)carbamoyl]-4-piperidyl]thiazole-4-carboxylic acid ethyl ester Formula: C19H22N4O5S MolecularWeight: 418.46678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)C2CCN(CC2)C(=O)NC3=C(C(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)C2CCN(CC2)C(=O)NC3=C(C(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C19H22N4O5S/c1-3-28-18(24)15-11-29-17(20-15)13-7-9-22(10-8-13)19(25)21-14-5-4-6-16(12(14)2)23(26)27/h4-6,11,13H,3,7-10H2,1-2H3,(H,21,25)