N-[2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]carbonylphenyl]-N-methyl-cyclopropanecarboxamide

Systemtic Name: N-[2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]carbonylphenyl]-N-methyl-cyclopropanecarboxamide Openeye Name: N-[2-[4-(azepan-1-ylsulfonyl)piperazine-1-carbonyl]phenyl]-N-methyl-cyclopropanecarboxamide CAS Name: N-[2-[[4-(1-azepanylsulfonyl)-1-piperazinyl]-oxomethyl]phenyl]-N-methylcyclopropanecarboxamide IUPAC Name: N-[2-[4-(azepan-1-ylsulfonyl)piperazine-1-carbonyl]phenyl]-N-methylcyclopropanecarboxamide Traditional Name: N-[2-[4-(azepan-1-ylsulfonyl)piperazine-1-carbonyl]phenyl]-N-methyl-cyclopropanecarboxamide Formula: C22H32N4O4S MolecularWeight: 448.57888

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)N2CCN(CC2)S(=O)(=O)N3CCCCCC3)C(=O)C4CC4

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)N2CCN(CC2)S(=O)(=O)N3CCCCCC3)C(=O)C4CC4

InChI

InChI=1S/C22H32N4O4S/c1-23(21(27)18-10-11-18)20-9-5-4-8-19(20)22(28)24-14-16-26(17-15-24)31(29,30)25-12-6-2-3-7-13-25/h4-5,8-9,18H,2-3,6-7,10-17H2,1H3