[4-[6-ethyl-5-[(4-methoxyphenyl)methyl]-2-methyl-pyrimidin-4-yl]-1,4-diazepan-1-yl]-naphthalen-2-yl-methanone

Systemtic Name: [4-[6-ethyl-5-[(4-methoxyphenyl)methyl]-2-methyl-pyrimidin-4-yl]-1,4-diazepan-1-yl]-naphthalen-2-yl-methanone Openeye Name: [4-[6-ethyl-5-[(4-methoxyphenyl)methyl]-2-methyl-pyrimidin-4-yl]-1,4-diazepan-1-yl]-(2-naphthyl)methanone CAS Name: [4-[6-ethyl-5-[(4-methoxyphenyl)methyl]-2-methyl-4-pyrimidinyl]-1,4-diazepan-1-yl]-(2-naphthalenyl)methanone IUPAC Name: [4-[6-ethyl-5-[(4-methoxyphenyl)methyl]-2-methylpyrimidin-4-yl]-1,4-diazepan-1-yl]-naphthalen-2-ylmethanone Traditional Name: [4-(6-ethyl-2-methyl-5-p-anisyl-pyrimidin-4-yl)-1,4-diazepan-1-yl]-(2-naphthyl)methanone Formula: C31H34N4O2 MolecularWeight: 494.62726

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C)N2CCCN(CC2)C(=O)C3=CC4=CC=CC=C4C=C3)CC5=CC=C(C=C5)OC

Isomeric SMILES

CCC1=C(C(=NC(=N1)C)N2CCCN(CC2)C(=O)C3=CC4=CC=CC=C4C=C3)CC5=CC=C(C=C5)OC

InChI

InChI=1S/C31H34N4O2/c1-4-29-28(20-23-10-14-27(37-3)15-11-23)30(33-22(2)32-29)34-16-7-17-35(19-18-34)31(36)26-13-12-24-8-5-6-9-25(24)21-26/h5-6,8-15,21H,4,7,16-20H2,1-3H3