N-[4-[2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanylcarbothioylhydrazinyl]-6-methyl-pyrimidin-2-yl]-N'-(phenylsulfonyl)carbamimidate

Systemtic Name: N-[4-[2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanylcarbothioylhydrazinyl]-6-methyl-pyrimidin-2-yl]-N'-(phenylsulfonyl)carbamimidate Openeye Name: N'-(benzenesulfonyl)-N-[4-[2-(2-ethoxy-2-oxo-ethyl)sulfanylcarbothioylhydrazino]-6-methyl-pyrimidin-2-yl]carbamimidate CAS Name: N'-(benzenesulfonyl)-N-[4-[[[(2-ethoxy-2-oxoethyl)thio]-sulfanylidenemethyl]hydrazo]-6-methyl-2-pyrimidinyl]carbamimidate IUPAC Name: N'-(benzenesulfonyl)-N-[4-[2-(2-ethoxy-2-oxoethyl)sulfanylcarbothioylhydrazinyl]-6-methylpyrimidin-2-yl]carbamimidate Traditional Name: N'-besyl-N-[4-[N'-[(2-ethoxy-2-keto-ethyl)thio]carbothioylhydrazino]-6-methyl-pyrimidin-2-yl]carbamimidate Formula: C17H19N6O5S3- MolecularWeight: 483.56496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC(=S)NNC1=NC(=NC(=C1)C)NC(=NS(=O)(=O)C2=CC=CC=C2)[O-]

Isomeric SMILES

CCOC(=O)CSC(=S)NNC1=NC(=NC(=C1)C)NC(=NS(=O)(=O)C2=CC=CC=C2)[O-]

InChI

InChI=1S/C17H20N6O5S3/c1-3-28-14(24)10-30-17(29)22-21-13-9-11(2)18-15(19-13)20-16(25)23-31(26,27)12-7-5-4-6-8-12/h4-9H,3,10H2,1-2H3,(H,22,29)(H3,18,19,20,21,23,25)/p-1