1,3-dimethyl-1-[(E)-(4-oxidanylidene-4-phenyl-butan-2-ylidene)amino]thiourea

Systemtic Name: 1,3-dimethyl-1-[(E)-(4-oxidanylidene-4-phenyl-butan-2-ylidene)amino]thiourea Openeye Name: 1,3-dimethyl-1-[(E)-(1-methyl-3-oxo-3-phenyl-propylidene)amino]thiourea CAS Name: 1,3-dimethyl-1-[(E)-(4-oxo-4-phenylbutan-2-ylidene)amino]thiourea IUPAC Name: 1,3-dimethyl-1-[(E)-(4-oxo-4-phenylbutan-2-ylidene)amino]thiourea Traditional Name: 1-[(E)-(3-keto-1-methyl-3-phenyl-propylidene)amino]-1,3-dimethyl-thiourea Formula: C13H17N3OS MolecularWeight: 263.35858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NN(C)C(=S)NC)CC(=O)C1=CC=CC=C1

Isomeric SMILES

C/C(=N\N(C)C(=S)NC)/CC(=O)C1=CC=CC=C1

InChI

InChI=1S/C13H17N3OS/c1-10(15-16(3)13(18)14-2)9-12(17)11-7-5-4-6-8-11/h4-8H,9H2,1-3H3,(H,14,18)/b15-10+