2-(4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(phenylcarbamoyl)propanamide

Systemtic Name: 2-(4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(phenylcarbamoyl)propanamide Openeye Name: 2-(3-allyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(phenylcarbamoyl)propanamide CAS Name: N-[anilino(oxo)methyl]-2-[(4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]propanamide IUPAC Name: 2-(4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(phenylcarbamoyl)propanamide Traditional Name: 2-[(3-allyl-4-keto-thieno[2,3-d]pyrimidin-2-yl)thio]-N-(phenylcarbamoyl)propionamide Formula: C19H18N4O3S2 MolecularWeight: 414.50122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1=CC=CC=C1)SC2=NC3=C(C=CS3)C(=O)N2CC=C

Isomeric SMILES

CC(C(=O)NC(=O)NC1=CC=CC=C1)SC2=NC3=C(C=CS3)C(=O)N2CC=C

InChI

InChI=1S/C19H18N4O3S2/c1-3-10-23-17(25)14-9-11-27-16(14)22-19(23)28-12(2)15(24)21-18(26)20-13-7-5-4-6-8-13/h3-9,11-12H,1,10H2,2H3,(H2,20,21,24,26)