cyclopropyl-[4-(4-methylsulfonylphenyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: cyclopropyl-[4-(4-methylsulfonylphenyl)-1,4-diazepan-1-yl]methanone Openeye Name: cyclopropyl-[4-(4-methylsulfonylphenyl)-1,4-diazepan-1-yl]methanone CAS Name: cyclopropyl-[4-(4-methylsulfonylphenyl)-1,4-diazepan-1-yl]methanone IUPAC Name: cyclopropyl-[4-(4-methylsulfonylphenyl)-1,4-diazepan-1-yl]methanone Traditional Name: cyclopropyl-[4-(4-mesylphenyl)-1,4-diazepan-1-yl]methanone Formula: C16H22N2O3S MolecularWeight: 322.42248

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)N2CCCN(CC2)C(=O)C3CC3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N2CCCN(CC2)C(=O)C3CC3

InChI

InChI=1S/C16H22N2O3S/c1-22(20,21)15-7-5-14(6-8-15)17-9-2-10-18(12-11-17)16(19)13-3-4-13/h5-8,13H,2-4,9-12H2,1H3