1-[(4-ethoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[(4-ethoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[(4-ethoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]thiourea CAS Name: 1-[(4-ethoxy-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[(4-ethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]thiourea Traditional Name: 1-benzyl-3-[(4-ethoxy-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]thiourea Formula: C17H19N3O2S MolecularWeight: 329.41666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=O)C(=CNNC(=S)NCC2=CC=CC=C2)C=C1

Isomeric SMILES

CCOC1=CC(=O)C(=CNNC(=S)NCC2=CC=CC=C2)C=C1

InChI

InChI=1S/C17H19N3O2S/c1-2-22-15-9-8-14(16(21)10-15)12-19-20-17(23)18-11-13-6-4-3-5-7-13/h3-10,12,19H,2,11H2,1H3,(H2,18,20,23)