methyl N'-[[(E)-(2-oxidanylidenenaphthalen-1-ylidene)methyl]amino]carbamimidothioate

Systemtic Name: methyl N'-[[(E)-(2-oxidanylidenenaphthalen-1-ylidene)methyl]amino]carbamimidothioate Openeye Name: 2-methyl-3-[[(E)-(2-oxo-1-naphthylidene)methyl]amino]isothiourea CAS Name: N'-[[(E)-(2-oxo-1-naphthalenylidene)methyl]amino]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-[[(E)-(2-oxonaphthalen-1-ylidene)methyl]amino]carbamimidothioate Traditional Name: 3-[[(E)-(2-keto-1-naphthylidene)methyl]amino]-2-methyl-isothiourea Formula: C13H13N3OS MolecularWeight: 259.32682

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NNC=C1C(=O)C=CC2=CC=CC=C21)N

Isomeric SMILES

CS/C(=N/N/C=C\1/C(=O)C=CC2=CC=CC=C21)/N

InChI

InChI=1S/C13H13N3OS/c1-18-13(14)16-15-8-11-10-5-3-2-4-9(10)6-7-12(11)17/h2-8,15H,1H3,(H2,14,16)/b11-8+