1-[(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-phenethyl-thiourea

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNNC(=S)NCCC2=CC=CC=C2)C=CC1=O

Isomeric SMILES

COC1=CC(=CNNC(=S)NCCC2=CC=CC=C2)C=CC1=O

InChI

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