2-[[4-(5-chloranyl-2-methoxy-phenyl)sulfonyl-1,4-diazepan-1-yl]methyl]-1,3-thiazole

Systemtic Name: 2-[[4-(5-chloranyl-2-methoxy-phenyl)sulfonyl-1,4-diazepan-1-yl]methyl]-1,3-thiazole Openeye Name: 2-[[4-(5-chloro-2-methoxy-phenyl)sulfonyl-1,4-diazepan-1-yl]methyl]thiazole CAS Name: 2-[[4-(5-chloro-2-methoxyphenyl)sulfonyl-1,4-diazepan-1-yl]methyl]thiazole IUPAC Name: 2-[[4-(5-chloro-2-methoxyphenyl)sulfonyl-1,4-diazepan-1-yl]methyl]-1,3-thiazole Traditional Name: 2-[[4-(5-chloro-2-methoxy-phenyl)sulfonyl-1,4-diazepan-1-yl]methyl]thiazole Formula: C16H20ClN3O3S2 MolecularWeight: 401.9313

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)S(=O)(=O)N2CCCN(CC2)CC3=NC=CS3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)S(=O)(=O)N2CCCN(CC2)CC3=NC=CS3

InChI

InChI=1S/C16H20ClN3O3S2/c1-23-14-4-3-13(17)11-15(14)25(21,22)20-7-2-6-19(8-9-20)12-16-18-5-10-24-16/h3-5,10-11H,2,6-9,12H2,1H3