N,N-diethyl-2-[(4-oxidanylidene-3-phenethyl-[1]benzothiolo[3,2-d]pyrimidin-2-yl)sulfanyl]butanamide

Systemtic Name: N,N-diethyl-2-[(4-oxidanylidene-3-phenethyl-[1]benzothiolo[3,2-d]pyrimidin-2-yl)sulfanyl]butanamide Openeye Name: N,N-diethyl-2-(4-oxo-3-phenethyl-benzothiopheno[3,2-d]pyrimidin-2-yl)sulfanyl-butanamide CAS Name: N,N-diethyl-2-[(4-oxo-3-phenethyl-[1]benzothiolo[3,2-d]pyrimidin-2-yl)thio]butanamide IUPAC Name: N,N-diethyl-2-[(4-oxo-3-phenethyl-[1]benzothiolo[3,2-d]pyrimidin-2-yl)sulfanyl]butanamide Traditional Name: N,N-diethyl-2-[(4-keto-3-phenethyl-benzothiopheno[3,2-d]pyrimidin-2-yl)thio]butyramide Formula: C26H29N3O2S2 MolecularWeight: 479.65736

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N(CC)CC)SC1=NC2=C(C(=O)N1CCC3=CC=CC=C3)SC4=CC=CC=C42

Isomeric SMILES

CCC(C(=O)N(CC)CC)SC1=NC2=C(C(=O)N1CCC3=CC=CC=C3)SC4=CC=CC=C42

InChI

InChI=1S/C26H29N3O2S2/c1-4-20(24(30)28(5-2)6-3)33-26-27-22-19-14-10-11-15-21(19)32-23(22)25(31)29(26)17-16-18-12-8-7-9-13-18/h7-15,20H,4-6,16-17H2,1-3H3