N-(1-ethylsulfonylpiperidin-4-yl)-4-(4-methylphenyl)sulfonyl-1,4-diazepane-1-carboxamide

Systemtic Name: N-(1-ethylsulfonylpiperidin-4-yl)-4-(4-methylphenyl)sulfonyl-1,4-diazepane-1-carboxamide Openeye Name: N-(1-ethylsulfonyl-4-piperidyl)-4-(p-tolylsulfonyl)-1,4-diazepane-1-carboxamide CAS Name: N-(1-ethylsulfonyl-4-piperidinyl)-4-(4-methylphenyl)sulfonyl-1,4-diazepane-1-carboxamide IUPAC Name: N-(1-ethylsulfonylpiperidin-4-yl)-4-(4-methylphenyl)sulfonyl-1,4-diazepane-1-carboxamide Traditional Name: N-(1-esyl-4-piperidyl)-4-tosyl-1,4-diazepane-1-carboxamide Formula: C20H32N4O5S2 MolecularWeight: 472.62188

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)NC(=O)N2CCCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)NC(=O)N2CCCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H32N4O5S2/c1-3-30(26,27)23-13-9-18(10-14-23)21-20(25)22-11-4-12-24(16-15-22)31(28,29)19-7-5-17(2)6-8-19/h5-8,18H,3-4,9-16H2,1-2H3,(H,21,25)