N-[6-azanyl-4-oxidanylidene-2-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-1H-pyrimidin-5-yl]benzamide

Systemtic Name: N-[6-azanyl-4-oxidanylidene-2-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-1H-pyrimidin-5-yl]benzamide Openeye Name: N-[6-amino-2-(2-anilino-2-oxo-ethyl)sulfanyl-4-oxo-1H-pyrimidin-5-yl]benzamide CAS Name: N-[6-amino-2-[(2-anilino-2-oxoethyl)thio]-4-oxo-1H-pyrimidin-5-yl]benzamide IUPAC Name: N-[6-amino-2-(2-anilino-2-oxoethyl)sulfanyl-4-oxo-1H-pyrimidin-5-yl]benzamide Traditional Name: N-[6-amino-2-[(2-anilino-2-keto-ethyl)thio]-4-keto-1H-pyrimidin-5-yl]benzamide Formula: C19H17N5O3S MolecularWeight: 395.43498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=C(NC(=NC2=O)SCC(=O)NC3=CC=CC=C3)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=C(NC(=NC2=O)SCC(=O)NC3=CC=CC=C3)N

InChI

InChI=1S/C19H17N5O3S/c20-16-15(22-17(26)12-7-3-1-4-8-12)18(27)24-19(23-16)28-11-14(25)21-13-9-5-2-6-10-13/h1-10H,11H2,(H,21,25)(H,22,26)(H3,20,23,24,27)