(3R)-1-(4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridin-2-yl)carbonylpiperidine-3-carboxamide

Systemtic Name: (3R)-1-(4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridin-2-yl)carbonylpiperidine-3-carboxamide Openeye Name: (3R)-1-(4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carbonyl)piperidine-3-carboxamide CAS Name: (3R)-1-[[4,6-dimethyl-3-(1-pyrrolyl)-2-thieno[2,3-b]pyridinyl]-oxomethyl]-3-piperidinecarboxamide IUPAC Name: (3R)-1-(4,6-dimethyl-3-pyrrol-1-ylthieno[2,3-b]pyridine-2-carbonyl)piperidine-3-carboxamide Traditional Name: (3R)-1-(4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carbonyl)nipecotamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=C(S2)C(=O)N3CCCC(C3)C(=O)N)N4C=CC=C4)C

Isomeric SMILES

CC1=CC(=NC2=C1C(=C(S2)C(=O)N3CCC[C@H](C3)C(=O)N)N4C=CC=C4)C

InChI

InChI=1S/C20H22N4O2S/c1-12-10-13(2)22-19-15(12)16(23-7-3-4-8-23)17(27-19)20(26)24-9-5-6-14(11-24)18(21)25/h3-4,7-8,10,14H,5-6,9,11H2,1-2H3,(H2,21,25)/t14-/m1/s1