(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: (2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone Openeye Name: (2-methoxy-5-morpholinosulfonyl-phenyl)-[4-(3-thienylmethyl)piperazin-1-yl]methanone CAS Name: [2-methoxy-5-(4-morpholinylsulfonyl)phenyl]-[4-(3-thiophenylmethyl)-1-piperazinyl]methanone IUPAC Name: (2-methoxy-5-morpholin-4-ylsulfonylphenyl)-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone Traditional Name: (2-methoxy-5-morpholinosulfonyl-phenyl)-[4-(3-thenyl)piperazino]methanone Formula: C21H27N3O5S2 MolecularWeight: 465.58618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)N3CCN(CC3)CC4=CSC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)N3CCN(CC3)CC4=CSC=C4

InChI

InChI=1S/C21H27N3O5S2/c1-28-20-3-2-18(31(26,27)24-9-11-29-12-10-24)14-19(20)21(25)23-7-5-22(6-8-23)15-17-4-13-30-16-17/h2-4,13-14,16H,5-12,15H2,1H3