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

Systemtic Name: 2-(4-oxidanylidene-3-prop-2-enyl-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-N-(4-phenylbutan-2-yl)propanamide Openeye Name: 2-(3-allyl-4-oxo-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-N-(1-methyl-3-phenyl-propyl)propanamide CAS Name: 2-[(4-oxo-3-prop-2-enyl-2-thieno[3,2-d]pyrimidinyl)thio]-N-(4-phenylbutan-2-yl)propanamide IUPAC Name: 2-(4-oxo-3-prop-2-enylthieno[3,2-d]pyrimidin-2-yl)sulfanyl-N-(4-phenylbutan-2-yl)propanamide Traditional Name: 2-[(3-allyl-4-keto-thieno[3,2-d]pyrimidin-2-yl)thio]-N-(1-methyl-3-phenyl-propyl)propionamide Formula: C22H25N3O2S2 MolecularWeight: 427.5828

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C(C)SC2=NC3=C(C(=O)N2CC=C)SC=C3

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)C(C)SC2=NC3=C(C(=O)N2CC=C)SC=C3

InChI

InChI=1S/C22H25N3O2S2/c1-4-13-25-21(27)19-18(12-14-28-19)24-22(25)29-16(3)20(26)23-15(2)10-11-17-8-6-5-7-9-17/h4-9,12,14-16H,1,10-11,13H2,2-3H3,(H,23,26)