(3,4-dimethylphenyl)-(4-methylsulfonyl-1,4-diazepan-1-yl)methanone

Systemtic Name: (3,4-dimethylphenyl)-(4-methylsulfonyl-1,4-diazepan-1-yl)methanone Openeye Name: (3,4-dimethylphenyl)-(4-methylsulfonyl-1,4-diazepan-1-yl)methanone CAS Name: (3,4-dimethylphenyl)-(4-methylsulfonyl-1,4-diazepan-1-yl)methanone IUPAC Name: (3,4-dimethylphenyl)-(4-methylsulfonyl-1,4-diazepan-1-yl)methanone Traditional Name: (3,4-dimethylphenyl)-(4-mesyl-1,4-diazepan-1-yl)methanone Formula: C15H22N2O3S MolecularWeight: 310.41178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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