(5Z)-5-[[6-[[(1R)-2,2-dimethyl-1-(5-methylthiophen-2-yl)propyl]amino]-1,3-dihydro-[1,2,5]thiadiazolo[3,4-b]pyrazin-5-yl]imino]-N,N-dimethyl-6-oxidanylidene-cyclohexa-1,3-diene-1-sulfonamide

Systemtic Name: (5Z)-5-[[6-[[(1R)-2,2-dimethyl-1-(5-methylthiophen-2-yl)propyl]amino]-1,3-dihydro-[1,2,5]thiadiazolo[3,4-b]pyrazin-5-yl]imino]-N,N-dimethyl-6-oxidanylidene-cyclohexa-1,3-diene-1-sulfonamide Openeye Name: (5Z)-5-[[6-[[(1R)-2,2-dimethyl-1-(5-methyl-2-thienyl)propyl]amino]-1,3-dihydro-[1,2,5]thiadiazolo[3,4-b]pyrazin-5-yl]imino]-N,N-dimethyl-6-oxo-cyclohexa-1,3-diene-1-sulfonamide CAS Name: (5Z)-5-[[6-[[(1R)-2,2-dimethyl-1-(5-methyl-2-thiophenyl)propyl]amino]-1,3-dihydro-[1,2,5]thiadiazolo[3,4-b]pyrazin-5-yl]imino]-N,N-dimethyl-6-oxo-1-cyclohexa-1,3-dienesulfonamide IUPAC Name: (5Z)-5-[[6-[[(1R)-2,2-dimethyl-1-(5-methylthiophen-2-yl)propyl]amino]-1,3-dihydro-[1,2,5]thiadiazolo[3,4-b]pyrazin-5-yl]imino]-N,N-dimethyl-6-oxocyclohexa-1,3-diene-1-sulfonamide Traditional Name: (5Z)-5-[[6-[[(1R)-2,2-dimethyl-1-(5-methyl-2-thienyl)propyl]amino]-1,3-dihydro-[1,2,5]thiadiazolo[3,4-b]pyrazin-5-yl]imino]-6-keto-N,N-dimethyl-cyclohexa-1,3-diene-1-sulfonamide Formula: C22H27N7O3S3 MolecularWeight: 533.68988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(C(C)(C)C)NC2=C(N=C3C(=N2)NSN3)N=C4C=CC=C(C4=O)S(=O)(=O)N(C)C

Isomeric SMILES

CC1=CC=C(S1)[C@@H](C(C)(C)C)NC2=C(N=C3C(=N2)NSN3)/N=C\4/C=CC=C(C4=O)S(=O)(=O)N(C)C

InChI

InChI=1S/C22H27N7O3S3/c1-12-10-11-14(33-12)17(22(2,3)4)24-19-18(25-20-21(26-19)28-34-27-20)23-13-8-7-9-15(16(13)30)35(31,32)29(5)6/h7-11,17H,1-6H3,(H,25,27)(H2,24,26,28)/b23-13-/t17-/m0/s1