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

Systemtic Name: 1-[(5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]thiourea Openeye Name: [(5-methoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]thiourea CAS Name: [(5-methoxy-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]thiourea IUPAC Name: [(5-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]thiourea Traditional Name: [(6-keto-5-methoxy-cyclohexa-2,4-dien-1-ylidene)methylamino]thiourea Formula: C9H11N3O2S MolecularWeight: 225.26754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=CNNC(=S)N)C1=O

Isomeric SMILES

COC1=CC=CC(=CNNC(=S)N)C1=O

InChI

InChI=1S/C9H11N3O2S/c1-14-7-4-2-3-6(8(7)13)5-11-12-9(10)15/h2-5,11H,1H3,(H3,10,12,15)