3-[[3-(aminomethyl)cyclohexyl]methyl]-6-methyl-2-naphthalen-1-yl-quinazolin-4-one

Systemtic Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-6-methyl-2-naphthalen-1-yl-quinazolin-4-one Openeye Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-6-methyl-2-(1-naphthyl)quinazolin-4-one CAS Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-6-methyl-2-(1-naphthalenyl)-4-quinazolinone IUPAC Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-6-methyl-2-naphthalen-1-ylquinazolin-4-one Traditional Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-6-methyl-2-(1-naphthyl)quinazolin-4-one Formula: C27H29N3O MolecularWeight: 411.53866

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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=CC5=CC=CC=C54

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N(C2=O)CC3CCCC(C3)CN)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C27H29N3O/c1-18-12-13-25-24(14-18)27(31)30(17-20-7-4-6-19(15-20)16-28)26(29-25)23-11-5-9-21-8-2-3-10-22(21)23/h2-3,5,8-14,19-20H,4,6-7,15-17,28H2,1H3