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

Systemtic Name: methyl 2-ethyl-4-methyl-5-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2-ethyl-4-methyl-5-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2-ethyl-4-methyl-5-[[(6-methyl-1,3-benzothiazol-2-yl)amino]-oxomethyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2-ethyl-4-methyl-5-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2-ethyl-4-methyl-5-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C)C)C(=O)OC

InChI

InChI=1S/C18H19N3O3S/c1-5-11-14(17(23)24-4)10(3)15(19-11)16(22)21-18-20-12-7-6-9(2)8-13(12)25-18/h6-8,19H,5H2,1-4H3,(H,20,21,22)