2-[[3-(3,4-dihydro-2H-pyrrol-5-ylamino)phenyl]methyl-methyl-amino]-6,7-dimethoxy-1H-quinazolin-4-one

Systemtic Name: 2-[[3-(3,4-dihydro-2H-pyrrol-5-ylamino)phenyl]methyl-methyl-amino]-6,7-dimethoxy-1H-quinazolin-4-one Openeye Name: 2-[[3-(3,4-dihydro-2H-pyrrol-5-ylamino)phenyl]methyl-methyl-amino]-6,7-dimethoxy-1H-quinazolin-4-one CAS Name: 2-[[3-(3,4-dihydro-2H-pyrrol-5-ylamino)phenyl]methyl-methylamino]-6,7-dimethoxy-1H-quinazolin-4-one IUPAC Name: 2-[[3-(3,4-dihydro-2H-pyrrol-5-ylamino)phenyl]methyl-methylamino]-6,7-dimethoxy-1H-quinazolin-4-one Traditional Name: 6,7-dimethoxy-2-[methyl-[3-(1-pyrrolin-2-ylamino)benzyl]amino]-1H-quinazolin-4-one Formula: C22H25N5O3 MolecularWeight: 407.4656

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)NC2=NCCC2)C3=NC(=O)C4=CC(=C(C=C4N3)OC)OC

Isomeric SMILES

CN(CC1=CC(=CC=C1)NC2=NCCC2)C3=NC(=O)C4=CC(=C(C=C4N3)OC)OC

InChI

InChI=1S/C22H25N5O3/c1-27(13-14-6-4-7-15(10-14)24-20-8-5-9-23-20)22-25-17-12-19(30-3)18(29-2)11-16(17)21(28)26-22/h4,6-7,10-12H,5,8-9,13H2,1-3H3,(H,23,24)(H,25,26,28)