1-(4-tert-butylphenyl)sulfonyl-5-[chloranyl-bis(fluoranyl)methyl]-2,3-dihydro-1,4-diazepine

Systemtic Name: 1-(4-tert-butylphenyl)sulfonyl-5-[chloranyl-bis(fluoranyl)methyl]-2,3-dihydro-1,4-diazepine Openeye Name: 1-(4-tert-butylphenyl)sulfonyl-5-[chloro(difluoro)methyl]-2,3-dihydro-1,4-diazepine CAS Name: 1-(4-tert-butylphenyl)sulfonyl-5-[chloro(difluoro)methyl]-2,3-dihydro-1,4-diazepine IUPAC Name: 1-(4-tert-butylphenyl)sulfonyl-5-[chloro(difluoro)methyl]-2,3-dihydro-1,4-diazepine Traditional Name: 1-(4-tert-butylphenyl)sulfonyl-5-[chloro(difluoro)methyl]-2,3-dihydro-1,4-diazepine Formula: C16H19ClF2N2O2S MolecularWeight: 376.849066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN=C(C=C2)C(F)(F)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN=C(C=C2)C(F)(F)Cl

InChI

InChI=1S/C16H19ClF2N2O2S/c1-15(2,3)12-4-6-13(7-5-12)24(22,23)21-10-8-14(16(17,18)19)20-9-11-21/h4-8,10H,9,11H2,1-3H3