(Z)-2-cyano-3-[[(2-oxidanylideneindol-3-yl)amino]carbamothioylamino]prop-2-enamide

Systemtic Name: (Z)-2-cyano-3-[[(2-oxidanylideneindol-3-yl)amino]carbamothioylamino]prop-2-enamide Openeye Name: (Z)-2-cyano-3-[[(2-oxoindol-3-yl)amino]carbamothioylamino]prop-2-enamide CAS Name: (Z)-2-cyano-3-[[[(2-oxo-3-indolyl)hydrazo]-sulfanylidenemethyl]amino]-2-propenamide IUPAC Name: (Z)-2-cyano-3-[[(2-oxoindol-3-yl)amino]carbamothioylamino]prop-2-enamide Traditional Name: (Z)-2-cyano-3-[[(2-ketoindol-3-yl)amino]thiocarbamoylamino]acrylamide Formula: C13H10N6O2S MolecularWeight: 314.3225

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=O)N=C2C=C1)NNC(=S)NC=C(C#N)C(=O)N

Isomeric SMILES

C1=CC2=C(C(=O)N=C2C=C1)NNC(=S)N/C=C(/C#N)\C(=O)N

InChI

InChI=1S/C13H10N6O2S/c14-5-7(11(15)20)6-16-13(22)19-18-10-8-3-1-2-4-9(8)17-12(10)21/h1-4,6H,(H2,15,20)(H2,16,19,22)(H,17,18,21)/b7-6-