2-[(3-cyclopentyl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N-[2-(4-methoxyphenyl)ethyl]ethanamide

Systemtic Name: 2-[(3-cyclopentyl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N-[2-(4-methoxyphenyl)ethyl]ethanamide Openeye Name: 2-[(3-cyclopentyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-[2-(4-methoxyphenyl)ethyl]acetamide CAS Name: 2-[(3-cyclopentyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)thio]-N-[2-(4-methoxyphenyl)ethyl]acetamide IUPAC Name: 2-[(3-cyclopentyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N-[2-(4-methoxyphenyl)ethyl]acetamide Traditional Name: 2-[(3-cyclopentyl-4-keto-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl)thio]-N-[2-(4-methoxyphenyl)ethyl]acetamide Formula: C26H31N3O3S2 MolecularWeight: 497.67264

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5CCCC5

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5CCCC5

InChI

InChI=1S/C26H31N3O3S2/c1-32-19-12-10-17(11-13-19)14-15-27-22(30)16-33-26-28-24-23(20-8-4-5-9-21(20)34-24)25(31)29(26)18-6-2-3-7-18/h10-13,18H,2-9,14-16H2,1H3,(H,27,30)