N-[[6-(4-methyl-1,4-diazepan-1-yl)pyridin-3-yl]methyl]-4-propan-2-yl-benzamide

Systemtic Name: N-[[6-(4-methyl-1,4-diazepan-1-yl)pyridin-3-yl]methyl]-4-propan-2-yl-benzamide Openeye Name: 4-isopropyl-N-[[6-(4-methyl-1,4-diazepan-1-yl)-3-pyridyl]methyl]benzamide CAS Name: N-[[6-(4-methyl-1,4-diazepan-1-yl)-3-pyridinyl]methyl]-4-propan-2-ylbenzamide IUPAC Name: N-[[6-(4-methyl-1,4-diazepan-1-yl)pyridin-3-yl]methyl]-4-propan-2-ylbenzamide Traditional Name: 4-isopropyl-N-[[6-(4-methyl-1,4-diazepan-1-yl)-3-pyridyl]methyl]benzamide Formula: C22H30N4O MolecularWeight: 366.4998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)NCC2=CN=C(C=C2)N3CCCN(CC3)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)NCC2=CN=C(C=C2)N3CCCN(CC3)C

InChI

InChI=1S/C22H30N4O/c1-17(2)19-6-8-20(9-7-19)22(27)24-16-18-5-10-21(23-15-18)26-12-4-11-25(3)13-14-26/h5-10,15,17H,4,11-14,16H2,1-3H3,(H,24,27)