(NE)-N-[azanyl-[(4,6,7-trimethylquinazolin-2-yl)amino]methylidene]phenothiazine-10-carboxamide

Systemtic Name: (NE)-N-[azanyl-[(4,6,7-trimethylquinazolin-2-yl)amino]methylidene]phenothiazine-10-carboxamide Openeye Name: (NE)-N-[amino-[(4,6,7-trimethylquinazolin-2-yl)amino]methylene]phenothiazine-10-carboxamide CAS Name: (NE)-N-[amino-[(4,6,7-trimethyl-2-quinazolinyl)amino]methylidene]-10-phenothiazinecarboxamide IUPAC Name: (NE)-N-[amino-[(4,6,7-trimethylquinazolin-2-yl)amino]methylidene]phenothiazine-10-carboxamide Traditional Name: (NE)-N-[amino-[(4,6,7-trimethylquinazolin-2-yl)amino]methylene]phenothiazine-10-carboxamide Formula: C25H22N6OS MolecularWeight: 454.54678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=NC(=N2)NC(=NC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)N)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=NC(=N2)N/C(=N/C(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)/N)C)C

InChI

InChI=1S/C25H22N6OS/c1-14-12-17-16(3)27-24(28-18(17)13-15(14)2)29-23(26)30-25(32)31-19-8-4-6-10-21(19)33-22-11-7-5-9-20(22)31/h4-13H,1-3H3,(H3,26,27,28,29,30,32)