methyl (E)-3-azanyl-2-(benzenecarbonothioylamino)but-2-enoate

Systemtic Name: methyl (E)-3-azanyl-2-(benzenecarbonothioylamino)but-2-enoate Openeye Name: methyl (E)-3-amino-2-(benzenecarbonothioylamino)but-2-enoate CAS Name: (E)-3-amino-2-(benzenecarbonothioylamino)-2-butenoic acid methyl ester IUPAC Name: methyl (E)-3-amino-2-(benzenecarbonothioylamino)but-2-enoate Traditional Name: (E)-3-amino-2-(benzenecarbonothioylamino)but-2-enoic acid methyl ester Formula: C12H14N2O2S MolecularWeight: 250.31676

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)OC)NC(=S)C1=CC=CC=C1)N

Isomeric SMILES

C/C(=C(/C(=O)OC)\NC(=S)C1=CC=CC=C1)/N

InChI

InChI=1S/C12H14N2O2S/c1-8(13)10(12(15)16-2)14-11(17)9-6-4-3-5-7-9/h3-7H,13H2,1-2H3,(H,14,17)/b10-8+