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

Systemtic Name: (4-tert-butylphenyl)-[4-(4-methylsulfonylphenyl)-1,4-diazepan-1-yl]methanone Openeye Name: (4-tert-butylphenyl)-[4-(4-methylsulfonylphenyl)-1,4-diazepan-1-yl]methanone CAS Name: (4-tert-butylphenyl)-[4-(4-methylsulfonylphenyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (4-tert-butylphenyl)-[4-(4-methylsulfonylphenyl)-1,4-diazepan-1-yl]methanone Traditional Name: (4-tert-butylphenyl)-[4-(4-mesylphenyl)-1,4-diazepan-1-yl]methanone Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCCN(CC2)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCCN(CC2)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C23H30N2O3S/c1-23(2,3)19-8-6-18(7-9-19)22(26)25-15-5-14-24(16-17-25)20-10-12-21(13-11-20)29(4,27)28/h6-13H,5,14-17H2,1-4H3