N-cyclohexyl-N-methyl-6-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methylsulfanyl]pyridine-3-sulfonamide

Systemtic Name: N-cyclohexyl-N-methyl-6-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methylsulfanyl]pyridine-3-sulfonamide Openeye Name: N-cyclohexyl-N-methyl-6-[(4-oxo-1,2,3-benzotriazin-3-yl)methylsulfanyl]pyridine-3-sulfonamide CAS Name: N-cyclohexyl-N-methyl-6-[(4-oxo-1,2,3-benzotriazin-3-yl)methylthio]-3-pyridinesulfonamide IUPAC Name: N-cyclohexyl-N-methyl-6-[(4-oxo-1,2,3-benzotriazin-3-yl)methylsulfanyl]pyridine-3-sulfonamide Traditional Name: N-cyclohexyl-6-[(4-keto-1,2,3-benzotriazin-3-yl)methylthio]-N-methyl-pyridine-3-sulfonamide Formula: C20H23N5O3S2 MolecularWeight: 445.55832

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)S(=O)(=O)C2=CN=C(C=C2)SCN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

CN(C1CCCCC1)S(=O)(=O)C2=CN=C(C=C2)SCN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H23N5O3S2/c1-24(15-7-3-2-4-8-15)30(27,28)16-11-12-19(21-13-16)29-14-25-20(26)17-9-5-6-10-18(17)22-23-25/h5-6,9-13,15H,2-4,7-8,14H2,1H3