1-[azanylcarbamothioyl-[(6E)-2-cyano-6-(1-pyridin-2-ylethylidene)cyclohexa-1,3-dien-1-yl]amino]-3-sulfanylidene-urea

Systemtic Name: 1-[azanylcarbamothioyl-[(6E)-2-cyano-6-(1-pyridin-2-ylethylidene)cyclohexa-1,3-dien-1-yl]amino]-3-sulfanylidene-urea Openeye Name: 1-[aminocarbamothioyl-[(6E)-2-cyano-6-[1-(2-pyridyl)ethylidene]cyclohexa-1,3-dien-1-yl]amino]-3-thioxo-urea CAS Name: 1-[[(6E)-2-cyano-6-[1-(2-pyridinyl)ethylidene]-1-cyclohexa-1,3-dienyl]-[hydrazinyl(sulfanylidene)methyl]amino]-3-sulfanylideneurea IUPAC Name: 1-[aminocarbamothioyl-[(6E)-2-cyano-6-(1-pyridin-2-ylethylidene)cyclohexa-1,3-dien-1-yl]amino]-3-sulfanylideneurea Traditional Name: 1-[aminothiocarbamoyl-[(6E)-2-cyano-6-[1-(2-pyridyl)ethylidene]cyclohexa-1,3-dien-1-yl]amino]-3-thioxo-urea Formula: C16H15N7OS2 MolecularWeight: 385.4666

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1CC=CC(=C1N(C(=S)NN)NC(=O)N=S)C#N)C2=CC=CC=N2

Isomeric SMILES

C/C(=C\1/CC=CC(=C1N(C(=S)NN)NC(=O)N=S)C#N)/C2=CC=CC=N2

InChI

InChI=1S/C16H15N7OS2/c1-10(13-7-2-3-8-19-13)12-6-4-5-11(9-17)14(12)23(16(25)20-18)21-15(24)22-26/h2-5,7-8H,6,18H2,1H3,(H,20,25)(H,21,24)/b12-10+