methyl (Z)-2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)-3-(4-piperidin-1-ylphenyl)prop-2-enoate

Systemtic Name: methyl (Z)-2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)-3-(4-piperidin-1-ylphenyl)prop-2-enoate Openeye Name: methyl (Z)-2-(4-oxo-2-thioxo-1H-pyrimidin-6-yl)-3-[4-(1-piperidyl)phenyl]prop-2-enoate CAS Name: (Z)-2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)-3-[4-(1-piperidinyl)phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)-3-(4-piperidin-1-ylphenyl)prop-2-enoate Traditional Name: (Z)-2-(4-keto-2-thioxo-1H-pyrimidin-6-yl)-3-(4-piperidinophenyl)acrylic acid methyl ester Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=CC=C(C=C1)N2CCCCC2)C3=CC(=O)NC(=S)N3

Isomeric SMILES

COC(=O)/C(=C\C1=CC=C(C=C1)N2CCCCC2)/C3=CC(=O)NC(=S)N3

InChI

InChI=1S/C19H21N3O3S/c1-25-18(24)15(16-12-17(23)21-19(26)20-16)11-13-5-7-14(8-6-13)22-9-3-2-4-10-22/h5-8,11-12H,2-4,9-10H2,1H3,(H2,20,21,23,26)/b15-11-