[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone

Systemtic Name: [4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone Openeye Name: [4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-(5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)methanone CAS Name: [4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]-(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone IUPAC Name: [4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone Traditional Name: [4-(4-methoxyphenyl)sulfonylpiperazino]-(5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)methanone Formula: C21H26N2O4S2 MolecularWeight: 434.57214

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C21H26N2O4S2/c1-15-3-8-19-16(13-15)14-20(28-19)21(24)22-9-11-23(12-10-22)29(25,26)18-6-4-17(27-2)5-7-18/h4-7,14-15H,3,8-13H2,1-2H3