methyl 2-ethyl-4-methyl-5-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylcarbamoyl)-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2-ethyl-4-methyl-5-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylcarbamoyl)-1H-pyrrole-3-carboxylate Openeye Name: methyl 2-ethyl-4-methyl-5-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylcarbamoyl)-1H-pyrrole-3-carboxylate CAS Name: 2-ethyl-4-methyl-5-[oxo-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)methyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2-ethyl-4-methyl-5-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylcarbamoyl)-1H-pyrrole-3-carboxylate Traditional Name: 2-ethyl-4-methyl-5-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylcarbamoyl)-1H-pyrrole-3-carboxylic acid methyl ester Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)NC2=NC3=C(S2)CCCC3)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)NC2=NC3=C(S2)CCCC3)C)C(=O)OC

InChI

InChI=1S/C17H21N3O3S/c1-4-10-13(16(22)23-3)9(2)14(18-10)15(21)20-17-19-11-7-5-6-8-12(11)24-17/h18H,4-8H2,1-3H3,(H,19,20,21)