6-[3-[4-(4-cyclohexylphenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propyl]-3-sulfanylidene-2H-1,2,4-triazin-5-one

Systemtic Name: 6-[3-[4-(4-cyclohexylphenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propyl]-3-sulfanylidene-2H-1,2,4-triazin-5-one Openeye Name: 6-[3-[4-(4-cyclohexylphenyl)sulfonylpiperazin-1-yl]-3-oxo-propyl]-3-thioxo-2H-1,2,4-triazin-5-one CAS Name: 6-[3-[4-(4-cyclohexylphenyl)sulfonyl-1-piperazinyl]-3-oxopropyl]-3-sulfanylidene-2H-1,2,4-triazin-5-one IUPAC Name: 6-[3-[4-(4-cyclohexylphenyl)sulfonylpiperazin-1-yl]-3-oxopropyl]-3-sulfanylidene-2H-1,2,4-triazin-5-one Traditional Name: 6-[3-[4-(4-cyclohexylphenyl)sulfonylpiperazino]-3-keto-propyl]-3-thioxo-2H-1,2,4-triazin-5-one Formula: C22H29N5O4S2 MolecularWeight: 491.62676

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)CCC4=NNC(=S)NC4=O

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)CCC4=NNC(=S)NC4=O

InChI

InChI=1S/C22H29N5O4S2/c28-20(11-10-19-21(29)23-22(32)25-24-19)26-12-14-27(15-13-26)33(30,31)18-8-6-17(7-9-18)16-4-2-1-3-5-16/h6-9,16H,1-5,10-15H2,(H2,23,25,29,32)