methyl 1-pyrrol-1-yl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-b]pyrrole-2-carboxylate

Systemtic Name: methyl 1-pyrrol-1-yl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-b]pyrrole-2-carboxylate Openeye Name: methyl 1-pyrrol-1-yl-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-b]pyrrole-2-carboxylate CAS Name: 1-(1-pyrrolyl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-b]pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 1-pyrrol-1-yl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-b]pyrrole-2-carboxylate Traditional Name: 1-pyrrol-1-yl-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-b]pyrrole-2-carboxylic acid methyl ester Formula: C16H16N2O2S MolecularWeight: 300.37544

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(N1)SC3=C2CCCC3)N4C=CC=C4

Isomeric SMILES

COC(=O)C1=C(C2=C(N1)SC3=C2CCCC3)N4C=CC=C4

InChI

InChI=1S/C16H16N2O2S/c1-20-16(19)13-14(18-8-4-5-9-18)12-10-6-2-3-7-11(10)21-15(12)17-13/h4-5,8-9,17H,2-3,6-7H2,1H3