5-(azepan-1-ylsulfonyl)-2-methoxy-N-methyl-N-[(4-methylphenyl)methyl]benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-methyl-N-[(4-methylphenyl)methyl]benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-methyl-N-(p-tolylmethyl)benzamide CAS Name: 5-(1-azepanylsulfonyl)-2-methoxy-N-methyl-N-[(4-methylphenyl)methyl]benzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-methyl-N-[(4-methylphenyl)methyl]benzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-methyl-N-(4-methylbenzyl)benzamide Formula: C23H30N2O4S MolecularWeight: 430.5603

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N2O4S/c1-18-8-10-19(11-9-18)17-24(2)23(26)21-16-20(12-13-22(21)29-3)30(27,28)25-14-6-4-5-7-15-25/h8-13,16H,4-7,14-15,17H2,1-3H3