3-[[3-(aminomethyl)cyclohexyl]methyl]-2-(3-methoxyphenyl)-6-methyl-quinazolin-4-one

Systemtic Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-2-(3-methoxyphenyl)-6-methyl-quinazolin-4-one Openeye Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-2-(3-methoxyphenyl)-6-methyl-quinazolin-4-one CAS Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-2-(3-methoxyphenyl)-6-methyl-4-quinazolinone IUPAC Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-2-(3-methoxyphenyl)-6-methylquinazolin-4-one Traditional Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-2-(3-methoxyphenyl)-6-methyl-quinazolin-4-one Formula: C24H29N3O2 MolecularWeight: 391.50596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N(C2=O)CC3CCCC(C3)CN)C4=CC(=CC=C4)OC

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N(C2=O)CC3CCCC(C3)CN)C4=CC(=CC=C4)OC

InChI

InChI=1S/C24H29N3O2/c1-16-9-10-22-21(11-16)24(28)27(15-18-6-3-5-17(12-18)14-25)23(26-22)19-7-4-8-20(13-19)29-2/h4,7-11,13,17-18H,3,5-6,12,14-15,25H2,1-2H3