7-methoxy-2-(4-morpholin-4-ylsulfonyl-1,4-diazepan-1-yl)-6-phenyl-quinazolin-4-amine hydrochloride

Systemtic Name: 7-methoxy-2-(4-morpholin-4-ylsulfonyl-1,4-diazepan-1-yl)-6-phenyl-quinazolin-4-amine hydrochloride Openeye Name: 7-methoxy-2-(4-morpholinosulfonyl-1,4-diazepan-1-yl)-6-phenyl-quinazolin-4-amine hydrochloride CAS Name: 7-methoxy-2-[4-(4-morpholinylsulfonyl)-1,4-diazepan-1-yl]-6-phenyl-4-quinazolinamine hydrochloride IUPAC Name: 7-methoxy-2-(4-morpholin-4-ylsulfonyl-1,4-diazepan-1-yl)-6-phenylquinazolin-4-amine hydrochloride Traditional Name: [7-methoxy-2-(4-morpholinosulfonyl-1,4-diazepan-1-yl)-6-phenyl-quinazolin-4-yl]amine hydrochloride Formula: C24H31ClN6O4S MolecularWeight: 535.05874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=C(N=C2N)N3CCCN(CC3)S(=O)(=O)N4CCOCC4)C5=CC=CC=C5.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)N=C(N=C2N)N3CCCN(CC3)S(=O)(=O)N4CCOCC4)C5=CC=CC=C5.Cl

InChI

InChI=1S/C24H30N6O4S.ClH/c1-33-22-17-21-20(16-19(22)18-6-3-2-4-7-18)23(25)27-24(26-21)28-8-5-9-29(11-10-28)35(31,32)30-12-14-34-15-13-30;/h2-4,6-7,16-17H,5,8-15H2,1H3,(H2,25,26,27);1H