2,2-diphenyl-1-[4-(2,5,6-trimethylpyrimidin-4-yl)-1,4-diazepan-1-yl]ethanone

Systemtic Name: 2,2-diphenyl-1-[4-(2,5,6-trimethylpyrimidin-4-yl)-1,4-diazepan-1-yl]ethanone Openeye Name: 2,2-diphenyl-1-[4-(2,5,6-trimethylpyrimidin-4-yl)-1,4-diazepan-1-yl]ethanone CAS Name: 2,2-diphenyl-1-[4-(2,5,6-trimethyl-4-pyrimidinyl)-1,4-diazepan-1-yl]ethanone IUPAC Name: 2,2-diphenyl-1-[4-(2,5,6-trimethylpyrimidin-4-yl)-1,4-diazepan-1-yl]ethanone Traditional Name: 2,2-diphenyl-1-[4-(2,5,6-trimethylpyrimidin-4-yl)-1,4-diazepan-1-yl]ethanone Formula: C26H30N4O MolecularWeight: 414.5426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1N2CCCN(CC2)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)C)C

Isomeric SMILES

CC1=C(N=C(N=C1N2CCCN(CC2)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)C)C

InChI

InChI=1S/C26H30N4O/c1-19-20(2)27-21(3)28-25(19)29-15-10-16-30(18-17-29)26(31)24(22-11-6-4-7-12-22)23-13-8-5-9-14-23/h4-9,11-14,24H,10,15-18H2,1-3H3