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

Systemtic Name: N-[6-acetamido-2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl]benzamide Openeye Name: N-[6-acetamido-2-(2-amino-2-oxo-ethyl)sulfanyl-4-oxo-1H-pyrimidin-5-yl]benzamide CAS Name: N-[6-acetamido-2-[(2-amino-2-oxoethyl)thio]-4-oxo-1H-pyrimidin-5-yl]benzamide IUPAC Name: N-[6-acetamido-2-(2-amino-2-oxoethyl)sulfanyl-4-oxo-1H-pyrimidin-5-yl]benzamide Traditional Name: N-[6-acetamido-2-[(2-amino-2-keto-ethyl)thio]-4-keto-1H-pyrimidin-5-yl]benzamide Formula: C15H15N5O4S MolecularWeight: 361.3757

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C(=O)N=C(N1)SCC(=O)N)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(=O)NC1=C(C(=O)N=C(N1)SCC(=O)N)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H15N5O4S/c1-8(21)17-12-11(18-13(23)9-5-3-2-4-6-9)14(24)20-15(19-12)25-7-10(16)22/h2-6H,7H2,1H3,(H2,16,22)(H,18,23)(H2,17,19,20,21,24)