methyl 2-[(3S,4R)-4-[[3,4-bis(chloranyl)-5-methyl-1H-pyrrol-2-yl]carbonylamino]-3-methyl-piperidin-1-yl]-4-(2-methyl-1,2,4-triazol-3-yl)-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-[(3S,4R)-4-[[3,4-bis(chloranyl)-5-methyl-1H-pyrrol-2-yl]carbonylamino]-3-methyl-piperidin-1-yl]-4-(2-methyl-1,2,4-triazol-3-yl)-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[(3S,4R)-4-[(3,4-dichloro-5-methyl-1H-pyrrole-2-carbonyl)amino]-3-methyl-1-piperidyl]-4-(2-methyl-1,2,4-triazol-3-yl)thiazole-5-carboxylate CAS Name: 2-[(3S,4R)-4-[[(3,4-dichloro-5-methyl-1H-pyrrol-2-yl)-oxomethyl]amino]-3-methyl-1-piperidinyl]-4-(2-methyl-1,2,4-triazol-3-yl)-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3S,4R)-4-[(3,4-dichloro-5-methyl-1H-pyrrole-2-carbonyl)amino]-3-methylpiperidin-1-yl]-4-(2-methyl-1,2,4-triazol-3-yl)-1,3-thiazole-5-carboxylate Traditional Name: 2-[(3S,4R)-4-[(3,4-dichloro-5-methyl-1H-pyrrole-2-carbonyl)amino]-3-methyl-piperidino]-4-(2-methyl-1,2,4-triazol-3-yl)thiazole-5-carboxylic acid methyl ester Formula: C20H23Cl2N7O3S MolecularWeight: 512.41272

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCC1NC(=O)C2=C(C(=C(N2)C)Cl)Cl)C3=NC(=C(S3)C(=O)OC)C4=NC=NN4C

Isomeric SMILES

C[C@H]1CN(CC[C@H]1NC(=O)C2=C(C(=C(N2)C)Cl)Cl)C3=NC(=C(S3)C(=O)OC)C4=NC=NN4C

InChI

InChI=1S/C20H23Cl2N7O3S/c1-9-7-29(6-5-11(9)26-18(30)14-13(22)12(21)10(2)25-14)20-27-15(16(33-20)19(31)32-4)17-23-8-24-28(17)3/h8-9,11,25H,5-7H2,1-4H3,(H,26,30)/t9-,11+/m0/s1