1-(3,4-dimethoxyphenyl)-3-[1-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea

Systemtic Name: 1-(3,4-dimethoxyphenyl)-3-[1-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea Openeye Name: 1-(3,4-dimethoxyphenyl)-3-[1-(2-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea CAS Name: 1-(3,4-dimethoxyphenyl)-3-[1-(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)ethylamino]thiourea IUPAC Name: 1-(3,4-dimethoxyphenyl)-3-[1-(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea Traditional Name: 1-(3,4-dimethoxyphenyl)-3-[1-(2-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea Formula: C17H19N3O4S MolecularWeight: 361.41546

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=CC(=O)C=C1O)NNC(=S)NC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(=C1C=CC(=O)C=C1O)NNC(=S)NC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C17H19N3O4S/c1-10(13-6-5-12(21)9-14(13)22)19-20-17(25)18-11-4-7-15(23-2)16(8-11)24-3/h4-9,19,22H,1-3H3,(H2,18,20,25)