N-[(3-chlorophenyl)methyl]-4-(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)butanamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-4-(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)butanamide Openeye Name: N-[(3-chlorophenyl)methyl]-4-(4-oxo-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)butanamide CAS Name: N-[(3-chlorophenyl)methyl]-4-(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)butanamide IUPAC Name: N-[(3-chlorophenyl)methyl]-4-(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)butanamide Traditional Name: N-(3-chlorobenzyl)-4-(4-keto-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)butyramide Formula: C17H16ClN3O2S2 MolecularWeight: 393.91084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CNC(=O)CCCN2C(=O)C3=C(C=CS3)NC2=S

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CNC(=O)CCCN2C(=O)C3=C(C=CS3)NC2=S

InChI

InChI=1S/C17H16ClN3O2S2/c18-12-4-1-3-11(9-12)10-19-14(22)5-2-7-21-16(23)15-13(6-8-25-15)20-17(21)24/h1,3-4,6,8-9H,2,5,7,10H2,(H,19,22)(H,20,24)