1-(2-methylphenyl)-3-[1-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)propylamino]thiourea

Systemtic Name: 1-(2-methylphenyl)-3-[1-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)propylamino]thiourea Openeye Name: 1-(o-tolyl)-3-[1-(4-oxocyclohexa-2,5-dien-1-ylidene)propylamino]thiourea CAS Name: 1-(2-methylphenyl)-3-[1-(4-oxo-1-cyclohexa-2,5-dienylidene)propylamino]thiourea IUPAC Name: 1-(2-methylphenyl)-3-[1-(4-oxocyclohexa-2,5-dien-1-ylidene)propylamino]thiourea Traditional Name: 1-[1-(4-ketocyclohexa-2,5-dien-1-ylidene)propylamino]-3-(o-tolyl)thiourea Formula: C17H19N3OS MolecularWeight: 313.41726

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C=CC(=O)C=C1)NNC(=S)NC2=CC=CC=C2C

Isomeric SMILES

CCC(=C1C=CC(=O)C=C1)NNC(=S)NC2=CC=CC=C2C

InChI

InChI=1S/C17H19N3OS/c1-3-15(13-8-10-14(21)11-9-13)19-20-17(22)18-16-7-5-4-6-12(16)2/h4-11,19H,3H2,1-2H3,(H2,18,20,22)