1-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methyl]-4-(5-chloranyl-2-methoxy-phenyl)sulfonyl-1,4-diazepane

Systemtic Name: 1-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methyl]-4-(5-chloranyl-2-methoxy-phenyl)sulfonyl-1,4-diazepane Openeye Name: 1-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methyl]-4-(5-chloro-2-methoxy-phenyl)sulfonyl-1,4-diazepane CAS Name: 1-[(5-chloro-1,3-dimethyl-4-pyrazolyl)methyl]-4-(5-chloro-2-methoxyphenyl)sulfonyl-1,4-diazepane IUPAC Name: 1-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-4-(5-chloro-2-methoxyphenyl)sulfonyl-1,4-diazepane Traditional Name: 1-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methyl]-4-(5-chloro-2-methoxy-phenyl)sulfonyl-1,4-diazepane Formula: C18H24Cl2N4O3S MolecularWeight: 447.37916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CN2CCCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)Cl)OC)Cl)C

Isomeric SMILES

CC1=NN(C(=C1CN2CCCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)Cl)OC)Cl)C

InChI

InChI=1S/C18H24Cl2N4O3S/c1-13-15(18(20)22(2)21-13)12-23-7-4-8-24(10-9-23)28(25,26)17-11-14(19)5-6-16(17)27-3/h5-6,11H,4,7-10,12H2,1-3H3