1-[[(1Z)-1-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)ethyl]amino]-3-phenethyl-thiourea

Systemtic Name: 1-[[(1Z)-1-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)ethyl]amino]-3-phenethyl-thiourea Openeye Name: 1-[[(1Z)-1-(2-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)ethyl]amino]-3-phenethyl-thiourea CAS Name: 1-[[(1Z)-1-(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)ethyl]amino]-3-phenethylthiourea IUPAC Name: 1-[[(1Z)-1-(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)ethyl]amino]-3-phenethylthiourea Traditional Name: 1-[[(1Z)-1-(2-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)ethyl]amino]-3-phenethyl-thiourea Formula: C17H19N3O2S MolecularWeight: 329.41666

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=CC(=O)C=C1O)NNC(=S)NCCC2=CC=CC=C2

Isomeric SMILES

C/C(=C/1\C=CC(=O)C=C1O)/NNC(=S)NCCC2=CC=CC=C2

InChI

InChI=1S/C17H19N3O2S/c1-12(15-8-7-14(21)11-16(15)22)19-20-17(23)18-10-9-13-5-3-2-4-6-13/h2-8,11,19,22H,9-10H2,1H3,(H2,18,20,23)/b15-12-