3-methyl-4-oxidanylidene-N-[3-(phenylcarbamoylamino)phenyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-methyl-4-oxidanylidene-N-[3-(phenylcarbamoylamino)phenyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-methyl-4-oxo-N-[3-(phenylcarbamoylamino)phenyl]-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[3-[[anilino(oxo)methyl]amino]phenyl]-3-methyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-methyl-4-oxo-N-[3-(phenylcarbamoylamino)phenyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 4-keto-3-methyl-N-[3-(phenylcarbamoylamino)phenyl]-2-thioxo-1H-quinazoline-7-carboxamide Formula: C23H19N5O3S MolecularWeight: 445.49366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC(=CC=C3)NC(=O)NC4=CC=CC=C4)NC1=S

Isomeric SMILES

CN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC(=CC=C3)NC(=O)NC4=CC=CC=C4)NC1=S

InChI

InChI=1S/C23H19N5O3S/c1-28-21(30)18-11-10-14(12-19(18)27-23(28)32)20(29)24-16-8-5-9-17(13-16)26-22(31)25-15-6-3-2-4-7-15/h2-13H,1H3,(H,24,29)(H,27,32)(H2,25,26,31)