(phenylmethyl) N-(4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridin-2-yl)carbamate

Systemtic Name: (phenylmethyl) N-(4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridin-2-yl)carbamate Openeye Name: benzyl N-(4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridin-2-yl)carbamate CAS Name: N-[4,6-dimethyl-3-(1-pyrrolyl)-2-thieno[2,3-b]pyridinyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(4,6-dimethyl-3-pyrrol-1-ylthieno[2,3-b]pyridin-2-yl)carbamate Traditional Name: N-(4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridin-2-yl)carbamic acid benzyl ester Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=C(S2)NC(=O)OCC3=CC=CC=C3)N4C=CC=C4)C

Isomeric SMILES

CC1=CC(=NC2=C1C(=C(S2)NC(=O)OCC3=CC=CC=C3)N4C=CC=C4)C

InChI

InChI=1S/C21H19N3O2S/c1-14-12-15(2)22-19-17(14)18(24-10-6-7-11-24)20(27-19)23-21(25)26-13-16-8-4-3-5-9-16/h3-12H,13H2,1-2H3,(H,23,25)