methyl N-[4-[2-[2-oxidanylidene-2-(3-oxidanylpropylamino)ethanoyl]hydrazinyl]phenyl]ethanimidothioate

Systemtic Name: methyl N-[4-[2-[2-oxidanylidene-2-(3-oxidanylpropylamino)ethanoyl]hydrazinyl]phenyl]ethanimidothioate Openeye Name: methyl N-[4-[2-[2-(3-hydroxypropylamino)-2-oxo-acetyl]hydrazino]phenyl]ethanimidothioate CAS Name: N-[4-[[2-(3-hydroxypropylamino)-1,2-dioxoethyl]hydrazo]phenyl]ethanimidothioic acid methyl ester IUPAC Name: methyl N-[4-[2-[2-(3-hydroxypropylamino)-2-oxoacetyl]hydrazinyl]phenyl]ethanimidothioate Traditional Name: N-[4-[N'-[2-(3-hydroxypropylamino)-2-keto-acetyl]hydrazino]phenyl]thioacetimidic acid methyl ester Formula: C14H20N4O3S MolecularWeight: 324.3986

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC1=CC=C(C=C1)NNC(=O)C(=O)NCCCO)SC

Isomeric SMILES

CC(=NC1=CC=C(C=C1)NNC(=O)C(=O)NCCCO)SC

InChI

InChI=1S/C14H20N4O3S/c1-10(22-2)16-11-4-6-12(7-5-11)17-18-14(21)13(20)15-8-3-9-19/h4-7,17,19H,3,8-9H2,1-2H3,(H,15,20)(H,18,21)