methyl 4-[2-(4,5,6,7-tetrahydro-1-benzothiophen-2-ylcarbonylamino)-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 4-[2-(4,5,6,7-tetrahydro-1-benzothiophen-2-ylcarbonylamino)-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxylate Openeye Name: methyl 4-[2-(4,5,6,7-tetrahydrobenzothiophene-2-carbonylamino)thiazol-4-yl]-1H-pyrrole-2-carboxylate CAS Name: 4-[2-[[oxo(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methyl]amino]-4-thiazolyl]-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-[2-(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonylamino)-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxylate Traditional Name: 4-[2-(4,5,6,7-tetrahydrobenzothiophene-2-carbonylamino)thiazol-4-yl]-1H-pyrrole-2-carboxylic acid methyl ester Formula: C18H17N3O3S2 MolecularWeight: 387.47588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CN1)C2=CSC(=N2)NC(=O)C3=CC4=C(S3)CCCC4

Isomeric SMILES

COC(=O)C1=CC(=CN1)C2=CSC(=N2)NC(=O)C3=CC4=C(S3)CCCC4

InChI

InChI=1S/C18H17N3O3S2/c1-24-17(23)12-6-11(8-19-12)13-9-25-18(20-13)21-16(22)15-7-10-4-2-3-5-14(10)26-15/h6-9,19H,2-5H2,1H3,(H,20,21,22)