N-(3-chloranyl-4-methyl-phenyl)-2-(4-oxidanylidene-5-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-(4-oxidanylidene-5-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-propanamide Openeye Name: 2-(3-allyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(3-chloro-4-methyl-phenyl)propanamide CAS Name: N-(3-chloro-4-methylphenyl)-2-[(4-oxo-5-phenyl-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]propanamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-(4-oxo-5-phenyl-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanylpropanamide Traditional Name: 2-[(3-allyl-4-keto-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]-N-(3-chloro-4-methyl-phenyl)propionamide Formula: C25H22ClN3O2S2 MolecularWeight: 496.04408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2CC=C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2CC=C)Cl

InChI

InChI=1S/C25H22ClN3O2S2/c1-4-12-29-24(31)21-19(17-8-6-5-7-9-17)14-32-23(21)28-25(29)33-16(3)22(30)27-18-11-10-15(2)20(26)13-18/h4-11,13-14,16H,1,12H2,2-3H3,(H,27,30)