2-[(4-oxidanylidene-3-phenethyl-[1]benzothiolo[3,2-d]pyrimidin-2-yl)sulfanyl]-N-phenyl-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[(4-oxidanylidene-3-phenethyl-[1]benzothiolo[3,2-d]pyrimidin-2-yl)sulfanyl]-N-phenyl-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-(4-oxo-3-phenethyl-benzothiopheno[3,2-d]pyrimidin-2-yl)sulfanyl-N-phenyl-acetamide CAS Name: 2-[(4-oxo-3-phenethyl-[1]benzothiolo[3,2-d]pyrimidin-2-yl)thio]-N-phenyl-N-prop-2-enylacetamide IUPAC Name: 2-[(4-oxo-3-phenethyl-[1]benzothiolo[3,2-d]pyrimidin-2-yl)sulfanyl]-N-phenyl-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[(4-keto-3-phenethyl-benzothiopheno[3,2-d]pyrimidin-2-yl)thio]-N-phenyl-acetamide Formula: C29H25N3O2S2 MolecularWeight: 511.6577

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(C1=CC=CC=C1)C(=O)CSC2=NC3=C(C(=O)N2CCC4=CC=CC=C4)SC5=CC=CC=C53

Isomeric SMILES

C=CCN(C1=CC=CC=C1)C(=O)CSC2=NC3=C(C(=O)N2CCC4=CC=CC=C4)SC5=CC=CC=C53

InChI

InChI=1S/C29H25N3O2S2/c1-2-18-31(22-13-7-4-8-14-22)25(33)20-35-29-30-26-23-15-9-10-16-24(23)36-27(26)28(34)32(29)19-17-21-11-5-3-6-12-21/h2-16H,1,17-20H2