3,4-dimethoxy-N-(2-pyridin-3-ylpiperidin-1-yl)carbothioyl-benzamide

Systemtic Name: 3,4-dimethoxy-N-(2-pyridin-3-ylpiperidin-1-yl)carbothioyl-benzamide Openeye Name: 3,4-dimethoxy-N-[2-(3-pyridyl)piperidine-1-carbothioyl]benzamide CAS Name: 3,4-dimethoxy-N-[[2-(3-pyridinyl)-1-piperidinyl]-sulfanylidenemethyl]benzamide IUPAC Name: 3,4-dimethoxy-N-(2-pyridin-3-ylpiperidine-1-carbothioyl)benzamide Traditional Name: 3,4-dimethoxy-N-[2-(3-pyridyl)piperidine-1-carbothioyl]benzamide Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)N2CCCCC2C3=CN=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)N2CCCCC2C3=CN=CC=C3)OC

InChI

InChI=1S/C20H23N3O3S/c1-25-17-9-8-14(12-18(17)26-2)19(24)22-20(27)23-11-4-3-7-16(23)15-6-5-10-21-13-15/h5-6,8-10,12-13,16H,3-4,7,11H2,1-2H3,(H,22,24,27)