prop-2-enyl N'-[[(E)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]carbamimidothioate

Systemtic Name: prop-2-enyl N'-[[(E)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]carbamimidothioate Openeye Name: 2-allyl-3-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]isothiourea CAS Name: N'-[[(E)-(6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]carbamimidothioic acid prop-2-enyl ester IUPAC Name: prop-2-enyl N'-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]carbamimidothioate Traditional Name: 2-allyl-3-[[(E)-(6-ketocyclohexa-2,4-dien-1-ylidene)methyl]amino]isothiourea Formula: C11H13N3OS MolecularWeight: 235.30542

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC(=NNC=C1C=CC=CC1=O)N

Isomeric SMILES

C=CCS/C(=N/N/C=C/1\C=CC=CC1=O)/N

InChI

InChI=1S/C11H13N3OS/c1-2-7-16-11(12)14-13-8-9-5-3-4-6-10(9)15/h2-6,8,13H,1,7H2,(H2,12,14)/b9-8+