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

Systemtic Name: 4-methyl-N-[6-[4-(2-methyl-1-oxidanyl-propan-2-yl)-1,4-diazepan-1-yl]pyridin-3-yl]benzamide Openeye Name: N-[6-[4-(2-hydroxy-1,1-dimethyl-ethyl)-1,4-diazepan-1-yl]-3-pyridyl]-4-methyl-benzamide CAS Name: N-[6-[4-(1-hydroxy-2-methylpropan-2-yl)-1,4-diazepan-1-yl]-3-pyridinyl]-4-methylbenzamide IUPAC Name: N-[6-[4-(1-hydroxy-2-methylpropan-2-yl)-1,4-diazepan-1-yl]pyridin-3-yl]-4-methylbenzamide Traditional Name: N-[6-[4-(2-hydroxy-1,1-dimethyl-ethyl)-1,4-diazepan-1-yl]-3-pyridyl]-4-methyl-benzamide Formula: C22H30N4O2 MolecularWeight: 382.4992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CN=C(C=C2)N3CCCN(CC3)C(C)(C)CO

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CN=C(C=C2)N3CCCN(CC3)C(C)(C)CO

InChI

InChI=1S/C22H30N4O2/c1-17-5-7-18(8-6-17)21(28)24-19-9-10-20(23-15-19)25-11-4-12-26(14-13-25)22(2,3)16-27/h5-10,15,27H,4,11-14,16H2,1-3H3,(H,24,28)