methyl 4-(1,3-benzothiazol-2-ylcarbamoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 4-(1,3-benzothiazol-2-ylcarbamoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 4-(1,3-benzothiazol-2-ylcarbamoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[(1,3-benzothiazol-2-ylamino)-oxomethyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(1,3-benzothiazol-2-ylcarbamoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-(1,3-benzothiazol-2-ylcarbamoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C)C(=O)OC)C(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=C(C(=C(N1)C)C(=O)OC)C(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H15N3O3S/c1-8-12(13(9(2)17-8)15(21)22-3)14(20)19-16-18-10-6-4-5-7-11(10)23-16/h4-7,17H,1-3H3,(H,18,19,20)