[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(5-chloranyl-2-methoxy-phenyl)methanone

Systemtic Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(5-chloranyl-2-methoxy-phenyl)methanone Openeye Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(5-chloro-2-methoxy-phenyl)methanone CAS Name: [4-(1-azepanylsulfonyl)-1-piperazinyl]-(5-chloro-2-methoxyphenyl)methanone IUPAC Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(5-chloro-2-methoxyphenyl)methanone Traditional Name: [4-(azepan-1-ylsulfonyl)piperazino]-(5-chloro-2-methoxy-phenyl)methanone Formula: C18H26ClN3O4S MolecularWeight: 415.93474

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(=O)N2CCN(CC2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(=O)N2CCN(CC2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C18H26ClN3O4S/c1-26-17-7-6-15(19)14-16(17)18(23)20-10-12-22(13-11-20)27(24,25)21-8-4-2-3-5-9-21/h6-7,14H,2-5,8-13H2,1H3