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

Systemtic Name: 4-(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)-N-phenethyl-butanamide Openeye Name: 4-(4-oxo-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)-N-phenethyl-butanamide CAS Name: 4-(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)-N-phenethylbutanamide IUPAC Name: 4-(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)-N-phenethylbutanamide Traditional Name: 4-(4-keto-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)-N-phenethyl-butyramide Formula: C18H19N3O2S2 MolecularWeight: 373.49236

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O2S2/c22-15(19-10-8-13-5-2-1-3-6-13)7-4-11-21-17(23)16-14(9-12-25-16)20-18(21)24/h1-3,5-6,9,12H,4,7-8,10-11H2,(H,19,22)(H,20,24)