3-(azepan-1-ylsulfonyl)-N,4-dimethyl-N-[(4-methylphenyl)methyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N,4-dimethyl-N-[(4-methylphenyl)methyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N,4-dimethyl-N-(p-tolylmethyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-N,4-dimethyl-N-[(4-methylphenyl)methyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N,4-dimethyl-N-[(4-methylphenyl)methyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N,4-dimethyl-N-(4-methylbenzyl)benzamide Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C)C(=O)C2=CC(=C(C=C2)C)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)CN(C)C(=O)C2=CC(=C(C=C2)C)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H30N2O3S/c1-18-8-11-20(12-9-18)17-24(3)23(26)21-13-10-19(2)22(16-21)29(27,28)25-14-6-4-5-7-15-25/h8-13,16H,4-7,14-15,17H2,1-3H3