1-[4-(3,4-dimethylphenyl)sulfonyl-1,4-diazepan-1-yl]ethanone

Systemtic Name: 1-[4-(3,4-dimethylphenyl)sulfonyl-1,4-diazepan-1-yl]ethanone Openeye Name: 1-[4-(3,4-dimethylphenyl)sulfonyl-1,4-diazepan-1-yl]ethanone CAS Name: 1-[4-(3,4-dimethylphenyl)sulfonyl-1,4-diazepan-1-yl]ethanone IUPAC Name: 1-[4-(3,4-dimethylphenyl)sulfonyl-1,4-diazepan-1-yl]ethanone Traditional Name: 1-[4-(3,4-dimethylphenyl)sulfonyl-1,4-diazepan-1-yl]ethanone Formula: C15H22N2O3S MolecularWeight: 310.41178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)C)C

InChI

InChI=1S/C15H22N2O3S/c1-12-5-6-15(11-13(12)2)21(19,20)17-8-4-7-16(9-10-17)14(3)18/h5-6,11H,4,7-10H2,1-3H3