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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C(=C(N3)C)C(=O)OC)C

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C(=C(N3)C)C(=O)OC)C

InChI

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