N-cyclohexyl-2-[3-[(4-methylphenyl)methyl]-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-cyclohexyl-2-[3-[(4-methylphenyl)methyl]-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-cyclohexyl-2-[4-oxo-3-(p-tolylmethyl)thieno[3,2-d]pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-cyclohexyl-2-[[3-[(4-methylphenyl)methyl]-4-oxo-2-thieno[3,2-d]pyrimidinyl]thio]acetamide IUPAC Name: N-cyclohexyl-2-[3-[(4-methylphenyl)methyl]-4-oxothieno[3,2-d]pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-cyclohexyl-2-[[4-keto-3-(4-methylbenzyl)thieno[3,2-d]pyrimidin-2-yl]thio]acetamide Formula: C22H25N3O2S2 MolecularWeight: 427.5828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=O)C3=C(C=CS3)N=C2SCC(=O)NC4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)C3=C(C=CS3)N=C2SCC(=O)NC4CCCCC4

InChI

InChI=1S/C22H25N3O2S2/c1-15-7-9-16(10-8-15)13-25-21(27)20-18(11-12-28-20)24-22(25)29-14-19(26)23-17-5-3-2-4-6-17/h7-12,17H,2-6,13-14H2,1H3,(H,23,26)