N-[2-chloranyl-4-[[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]sulfonyl]phenyl]ethanamide

Systemtic Name: N-[2-chloranyl-4-[[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]sulfonyl]phenyl]ethanamide Openeye Name: N-[2-chloro-4-[[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]sulfonyl]phenyl]acetamide CAS Name: N-[2-chloro-4-[[4-[(1-methyl-2-imidazolyl)methyl]-1,4-diazepan-1-yl]sulfonyl]phenyl]acetamide IUPAC Name: N-[2-chloro-4-[[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]sulfonyl]phenyl]acetamide Traditional Name: N-[2-chloro-4-[[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]sulfonyl]phenyl]acetamide Formula: C18H24ClN5O3S MolecularWeight: 425.93286

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)N2CCCN(CC2)CC3=NC=CN3C)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)N2CCCN(CC2)CC3=NC=CN3C)Cl

InChI

InChI=1S/C18H24ClN5O3S/c1-14(25)21-17-5-4-15(12-16(17)19)28(26,27)24-8-3-7-23(10-11-24)13-18-20-6-9-22(18)2/h4-6,9,12H,3,7-8,10-11,13H2,1-2H3,(H,21,25)