3-ethyl-8-[[4-[(phenylmethyl)amino]phenyl]methylamino]-1H-imidazo[4,5-g]quinazoline-2-thione

Systemtic Name: 3-ethyl-8-[[4-[(phenylmethyl)amino]phenyl]methylamino]-1H-imidazo[4,5-g]quinazoline-2-thione Openeye Name: 8-[[4-(benzylamino)phenyl]methylamino]-3-ethyl-1H-imidazo[4,5-g]quinazoline-2-thione CAS Name: 3-ethyl-8-[[4-[(phenylmethyl)amino]phenyl]methylamino]-1H-imidazo[4,5-g]quinazoline-2-thione IUPAC Name: 8-[[4-(benzylamino)phenyl]methylamino]-3-ethyl-1H-imidazo[4,5-g]quinazoline-2-thione Traditional Name: 8-[[4-(benzylamino)benzyl]amino]-3-ethyl-1H-imidazo[4,5-g]quinazoline-2-thione Formula: C25H24N6S MolecularWeight: 440.56326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C3C(=C2)N=CN=C3NCC4=CC=C(C=C4)NCC5=CC=CC=C5)NC1=S

Isomeric SMILES

CCN1C2=C(C=C3C(=C2)N=CN=C3NCC4=CC=C(C=C4)NCC5=CC=CC=C5)NC1=S

InChI

InChI=1S/C25H24N6S/c1-2-31-23-13-21-20(12-22(23)30-25(31)32)24(29-16-28-21)27-15-18-8-10-19(11-9-18)26-14-17-6-4-3-5-7-17/h3-13,16,26H,2,14-15H2,1H3,(H,30,32)(H,27,28,29)