(6Z)-4-chloranyl-3-oxidanyl-6-[4-(4-thiophen-3-ylsulfonylpiperazin-1-yl)-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-4-chloranyl-3-oxidanyl-6-[4-(4-thiophen-3-ylsulfonylpiperazin-1-yl)-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-4-chloro-3-hydroxy-6-[4-[4-(3-thienylsulfonyl)piperazin-1-yl]-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: (6Z)-4-chloro-3-hydroxy-6-[4-[4-(3-thiophenylsulfonyl)-1-piperazinyl]-1,2-dihydropyrazol-3-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-4-chloro-3-hydroxy-6-[4-(4-thiophen-3-ylsulfonylpiperazin-1-yl)-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6Z)-4-chloro-3-hydroxy-6-[4-[4-(3-thienylsulfonyl)piperazino]-3-pyrazolin-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C17H17ClN4O4S2 MolecularWeight: 440.92428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CNNC2=C3C=C(C(=CC3=O)O)Cl)S(=O)(=O)C4=CSC=C4

Isomeric SMILES

C1CN(CCN1C\2=CNN/C2=C\3/C=C(C(=CC3=O)O)Cl)S(=O)(=O)C4=CSC=C4

InChI

InChI=1S/C17H17ClN4O4S2/c18-13-7-12(15(23)8-16(13)24)17-14(9-19-20-17)21-2-4-22(5-3-21)28(25,26)11-1-6-27-10-11/h1,6-10,19-20,24H,2-5H2/b17-12-