ethyl 2,5-dimethyl-4-[3-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]piperidin-1-yl]sulfonyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-4-[3-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]piperidin-1-yl]sulfonyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-4-[[3-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]-1-piperidyl]sulfonyl]-1H-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-4-[[3-[[(6-methyl-1,3-benzothiazol-2-yl)amino]-oxomethyl]-1-piperidinyl]sulfonyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-4-[3-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]piperidin-1-yl]sulfonyl-1H-pyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-4-[3-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]piperidino]sulfonyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C23H28N4O5S2 MolecularWeight: 504.62222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1S(=O)(=O)N2CCCC(C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1S(=O)(=O)N2CCCC(C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)C)C)C

InChI

InChI=1S/C23H28N4O5S2/c1-5-32-22(29)19-14(3)24-15(4)20(19)34(30,31)27-10-6-7-16(12-27)21(28)26-23-25-17-9-8-13(2)11-18(17)33-23/h8-9,11,16,24H,5-7,10,12H2,1-4H3,(H,25,26,28)