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

Systemtic Name: N-[6-[4-[(4-dimethylaminophenyl)methyl]-1,4-diazepan-1-yl]pyridin-3-yl]benzamide Openeye Name: N-[6-[4-[(4-dimethylaminophenyl)methyl]-1,4-diazepan-1-yl]-3-pyridyl]benzamide CAS Name: N-[6-[4-[(4-dimethylaminophenyl)methyl]-1,4-diazepan-1-yl]-3-pyridinyl]benzamide IUPAC Name: N-[6-[4-[(4-dimethylaminophenyl)methyl]-1,4-diazepan-1-yl]pyridin-3-yl]benzamide Traditional Name: N-[6-[4-[4-(dimethylamino)benzyl]-1,4-diazepan-1-yl]-3-pyridyl]benzamide Formula: C26H31N5O MolecularWeight: 429.55724

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CN2CCCN(CC2)C3=NC=C(C=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CN2CCCN(CC2)C3=NC=C(C=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H31N5O/c1-29(2)24-12-9-21(10-13-24)20-30-15-6-16-31(18-17-30)25-14-11-23(19-27-25)28-26(32)22-7-4-3-5-8-22/h3-5,7-14,19H,6,15-18,20H2,1-2H3,(H,28,32)