1-[(6-oxidanylidene-5-prop-2-enyl-cyclohexa-2,4-dien-1-ylidene)methylamino]thiourea

Systemtic Name: 1-[(6-oxidanylidene-5-prop-2-enyl-cyclohexa-2,4-dien-1-ylidene)methylamino]thiourea Openeye Name: [(5-allyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]thiourea CAS Name: [(6-oxo-5-prop-2-enyl-1-cyclohexa-2,4-dienylidene)methylamino]thiourea IUPAC Name: [(6-oxo-5-prop-2-enylcyclohexa-2,4-dien-1-ylidene)methylamino]thiourea Traditional Name: [(5-allyl-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]thiourea Formula: C11H13N3OS MolecularWeight: 235.30542

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC(=CNNC(=S)N)C1=O

Isomeric SMILES

C=CCC1=CC=CC(=CNNC(=S)N)C1=O

InChI

InChI=1S/C11H13N3OS/c1-2-4-8-5-3-6-9(10(8)15)7-13-14-11(12)16/h2-3,5-7,13H,1,4H2,(H3,12,14,16)