N-(4-methoxyphenyl)-4-[(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]cyclohexane-1-carboxamide

Systemtic Name: N-(4-methoxyphenyl)-4-[(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]cyclohexane-1-carboxamide Openeye Name: N-(4-methoxyphenyl)-4-[(4-oxo-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]cyclohexanecarboxamide CAS Name: N-(4-methoxyphenyl)-4-[(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]-1-cyclohexanecarboxamide IUPAC Name: N-(4-methoxyphenyl)-4-[(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]cyclohexane-1-carboxamide Traditional Name: 4-[(4-keto-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]-N-(4-methoxyphenyl)cyclohexanecarboxamide Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2CCC(CC2)CN3C(=O)C4=C(C=CS4)NC3=S

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2CCC(CC2)CN3C(=O)C4=C(C=CS4)NC3=S

InChI

InChI=1S/C21H23N3O3S2/c1-27-16-8-6-15(7-9-16)22-19(25)14-4-2-13(3-5-14)12-24-20(26)18-17(10-11-29-18)23-21(24)28/h6-11,13-14H,2-5,12H2,1H3,(H,22,25)(H,23,28)