N-(3-methylphenyl)-6-(1-oxidanylidene-1,4-thiazinan-4-yl)pyrimido[5,4-d]pyrimidin-4-amine

Systemtic Name: N-(3-methylphenyl)-6-(1-oxidanylidene-1,4-thiazinan-4-yl)pyrimido[5,4-d]pyrimidin-4-amine Openeye Name: N-(m-tolyl)-6-(1-oxo-1,4-thiazinan-4-yl)pyrimido[5,4-d]pyrimidin-4-amine CAS Name: N-(3-methylphenyl)-6-(1-oxo-1,4-thiazinan-4-yl)-4-pyrimido[5,4-d]pyrimidinamine IUPAC Name: N-(3-methylphenyl)-6-(1-oxo-1,4-thiazinan-4-yl)pyrimido[5,4-d]pyrimidin-4-amine Traditional Name: [6-(1-keto-1,4-thiazinan-4-yl)pyrimido[5,4-d]pyrimidin-4-yl]-(m-tolyl)amine Formula: C17H18N6OS MolecularWeight: 354.42942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC=NC3=CN=C(N=C32)N4CCS(=O)CC4

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC=NC3=CN=C(N=C32)N4CCS(=O)CC4

InChI

InChI=1S/C17H18N6OS/c1-12-3-2-4-13(9-12)21-16-15-14(19-11-20-16)10-18-17(22-15)23-5-7-25(24)8-6-23/h2-4,9-11H,5-8H2,1H3,(H,19,20,21)