[1-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperidin-4-yl]-(3-methoxyphenyl)methanone; methanesulfonic acid

Systemtic Name: [1-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperidin-4-yl]-(3-methoxyphenyl)methanone; methanesulfonic acid Openeye Name: [1-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-4-piperidyl]-(3-methoxyphenyl)methanone; methanesulfonic acid CAS Name: [1-(4-amino-6,7-dimethoxy-2-quinazolinyl)-4-piperidinyl]-(3-methoxyphenyl)methanone; methanesulfonic acid IUPAC Name: [1-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperidin-4-yl]-(3-methoxyphenyl)methanone; methanesulfonic acid Traditional Name: [1-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-4-piperidyl]-(3-methoxyphenyl)methanone; mesylic acid Formula: C24H30N4O7S MolecularWeight: 518.5826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)C2CCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC.CS(=O)(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)C2CCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC.CS(=O)(=O)O

InChI

InChI=1S/C23H26N4O4.CH4O3S/c1-29-16-6-4-5-15(11-16)21(28)14-7-9-27(10-8-14)23-25-18-13-20(31-3)19(30-2)12-17(18)22(24)26-23;1-5(2,3)4/h4-6,11-14H,7-10H2,1-3H3,(H2,24,25,26);1H3,(H,2,3,4)