1-[(E)-4-(2-ethoxy-4-oxidanyl-phenyl)butan-2-ylideneamino]thiourea

Systemtic Name: 1-[(E)-4-(2-ethoxy-4-oxidanyl-phenyl)butan-2-ylideneamino]thiourea Openeye Name: [(E)-[3-(2-ethoxy-4-hydroxy-phenyl)-1-methyl-propylidene]amino]thiourea CAS Name: [(E)-4-(2-ethoxy-4-hydroxyphenyl)butan-2-ylideneamino]thiourea IUPAC Name: [(E)-4-(2-ethoxy-4-hydroxyphenyl)butan-2-ylideneamino]thiourea Traditional Name: [(E)-[3-(2-ethoxy-4-hydroxy-phenyl)-1-methyl-propylidene]amino]thiourea Formula: C13H19N3O2S MolecularWeight: 281.37386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)O)CCC(=NNC(=S)N)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)O)CC/C(=N/NC(=S)N)/C

InChI

InChI=1S/C13H19N3O2S/c1-3-18-12-8-11(17)7-6-10(12)5-4-9(2)15-16-13(14)19/h6-8,17H,3-5H2,1-2H3,(H3,14,16,19)/b15-9+