N-[(2-methylphenyl)methyl]-2-(4-oxidanylidene-3-prop-2-enyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(2-methylphenyl)methyl]-2-(4-oxidanylidene-3-prop-2-enyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: 2-[3-allyl-4-oxo-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-(o-tolylmethyl)acetamide CAS Name: N-[(2-methylphenyl)methyl]-2-[(4-oxo-3-prop-2-enyl-5-thiophen-2-yl-2-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-[(2-methylphenyl)methyl]-2-(4-oxo-3-prop-2-enyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: 2-[[3-allyl-4-keto-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]thio]-N-(2-methylbenzyl)acetamide Formula: C23H21N3O2S3 MolecularWeight: 467.62674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)CSC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2CC=C

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)CSC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2CC=C

InChI

InChI=1S/C23H21N3O2S3/c1-3-10-26-22(28)20-17(18-9-6-11-29-18)13-30-21(20)25-23(26)31-14-19(27)24-12-16-8-5-4-7-15(16)2/h3-9,11,13H,1,10,12,14H2,2H3,(H,24,27)