S-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)] N-(4-methoxyphenyl)carbamothioate

Systemtic Name: S-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)] N-(4-methoxyphenyl)carbamothioate Openeye Name: S-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)] N-(4-methoxyphenyl)carbamothioate CAS Name: N-(4-methoxyphenyl)carbamothioic acid S-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)] ester IUPAC Name: S-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)] N-(4-methoxyphenyl)carbamothioate Traditional Name: N-(4-methoxyphenyl)thiocarbamic acid S-[(3-cyano-1-pyrindan-2-yl)] ester Formula: C17H15N3O2S MolecularWeight: 325.3849

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)SC2=NC3=C(CCC3)C=C2C#N

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)SC2=NC3=C(CCC3)C=C2C#N

InChI

InChI=1S/C17H15N3O2S/c1-22-14-7-5-13(6-8-14)19-17(21)23-16-12(10-18)9-11-3-2-4-15(11)20-16/h5-9H,2-4H2,1H3,(H,19,21)