N-(1,3-benzothiazol-2-yl)-2-[4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-6-yl]ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-[4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-6-yl]ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-(2-benzylsulfanyl-4-oxo-1H-pyrimidin-6-yl)acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[4-oxo-2-(phenylmethylthio)-1H-pyrimidin-6-yl]acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(2-benzylsulfanyl-4-oxo-1H-pyrimidin-6-yl)acetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[2-(benzylthio)-4-keto-1H-pyrimidin-6-yl]acetamide Formula: C20H16N4O2S2 MolecularWeight: 408.49664

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC(=O)C=C(N2)CC(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC(=O)C=C(N2)CC(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H16N4O2S2/c25-17-10-14(21-19(23-17)27-12-13-6-2-1-3-7-13)11-18(26)24-20-22-15-8-4-5-9-16(15)28-20/h1-10H,11-12H2,(H,21,23,25)(H,22,24,26)