3-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-6-chloranyl-4-phenyl-1H-quinolin-2-one

Systemtic Name: 3-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-6-chloranyl-4-phenyl-1H-quinolin-2-one Openeye Name: 3-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-6-chloro-4-phenyl-1H-quinolin-2-one CAS Name: 3-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]-6-chloro-4-phenyl-1H-quinolin-2-one IUPAC Name: 3-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-6-chloro-4-phenyl-1H-quinolin-2-one Traditional Name: 3-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]-6-chloro-4-phenyl-carbostyril Formula: C19H13ClN4O2S MolecularWeight: 396.85012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)NC3=C2C=C(C=C3)Cl)SC4=NC(=O)C=C(N4)N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)NC3=C2C=C(C=C3)Cl)SC4=NC(=O)C=C(N4)N

InChI

InChI=1S/C19H13ClN4O2S/c20-11-6-7-13-12(8-11)16(10-4-2-1-3-5-10)17(18(26)22-13)27-19-23-14(21)9-15(25)24-19/h1-9H,(H,22,26)(H3,21,23,24,25)