N-[2-(4-methylphenyl)sulfanylethyl]-2-(4-oxidanylidene-3-prop-2-enyl-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(4-methylphenyl)sulfanylethyl]-2-(4-oxidanylidene-3-prop-2-enyl-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-N-[2-(p-tolylsulfanyl)ethyl]acetamide CAS Name: N-[2-[(4-methylphenyl)thio]ethyl]-2-[(4-oxo-3-prop-2-enyl-2-thieno[3,2-d]pyrimidinyl)thio]acetamide IUPAC Name: N-[2-(4-methylphenyl)sulfanylethyl]-2-(4-oxo-3-prop-2-enylthieno[3,2-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-allyl-4-keto-thieno[3,2-d]pyrimidin-2-yl)thio]-N-[2-(p-tolylthio)ethyl]acetamide Formula: C20H21N3O2S3 MolecularWeight: 431.59464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)CSC2=NC3=C(C(=O)N2CC=C)SC=C3

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)CSC2=NC3=C(C(=O)N2CC=C)SC=C3

InChI

InChI=1S/C20H21N3O2S3/c1-3-10-23-19(25)18-16(8-11-27-18)22-20(23)28-13-17(24)21-9-12-26-15-6-4-14(2)5-7-15/h3-8,11H,1,9-10,12-13H2,2H3,(H,21,24)