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

Systemtic Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-6-methyl-2-naphthalen-2-yl-quinazolin-4-one Openeye Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-6-methyl-2-(2-naphthyl)quinazolin-4-one CAS Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-6-methyl-2-(2-naphthalenyl)-4-quinazolinone IUPAC Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-6-methyl-2-naphthalen-2-ylquinazolin-4-one Traditional Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-6-methyl-2-(2-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=CC5=CC=CC=C5C=C4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N(C2=O)CC3CCCC(C3)CN)C4=CC5=CC=CC=C5C=C4

InChI

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