[4-(1,3-dithian-2-yl)phenyl]-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [4-(1,3-dithian-2-yl)phenyl]-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: [4-(1,3-dithian-2-yl)phenyl]-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: [4-(1,3-dithian-2-yl)phenyl]-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: [4-(1,3-dithian-2-yl)phenyl]-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [4-(1,3-dithian-2-yl)phenyl]-[4-(4-methoxyphenyl)sulfonylpiperazino]methanone Formula: C22H26N2O4S3 MolecularWeight: 478.64784

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C4SCCCS4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C4SCCCS4

InChI

InChI=1S/C22H26N2O4S3/c1-28-19-7-9-20(10-8-19)31(26,27)24-13-11-23(12-14-24)21(25)17-3-5-18(6-4-17)22-29-15-2-16-30-22/h3-10,22H,2,11-16H2,1H3