1-[1-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)propylamino]-3-phenyl-thiourea

Systemtic Name: 1-[1-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)propylamino]-3-phenyl-thiourea Openeye Name: 1-[1-(4-oxocyclohexa-2,5-dien-1-ylidene)propylamino]-3-phenyl-thiourea CAS Name: 1-[1-(4-oxo-1-cyclohexa-2,5-dienylidene)propylamino]-3-phenylthiourea IUPAC Name: 1-[1-(4-oxocyclohexa-2,5-dien-1-ylidene)propylamino]-3-phenylthiourea Traditional Name: 1-[1-(4-ketocyclohexa-2,5-dien-1-ylidene)propylamino]-3-phenyl-thiourea Formula: C16H17N3OS MolecularWeight: 299.39068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C=CC(=O)C=C1)NNC(=S)NC2=CC=CC=C2

Isomeric SMILES

CCC(=C1C=CC(=O)C=C1)NNC(=S)NC2=CC=CC=C2

InChI

InChI=1S/C16H17N3OS/c1-2-15(12-8-10-14(20)11-9-12)18-19-16(21)17-13-6-4-3-5-7-13/h3-11,18H,2H2,1H3,(H2,17,19,21)