1-(2-ethyl-6-methyl-phenyl)-3-[[5-(hydroxymethyl)-2-methyl-3-oxidanylidene-pyridin-4-ylidene]methylamino]thiourea

Systemtic Name: 1-(2-ethyl-6-methyl-phenyl)-3-[[5-(hydroxymethyl)-2-methyl-3-oxidanylidene-pyridin-4-ylidene]methylamino]thiourea Openeye Name: 1-(2-ethyl-6-methyl-phenyl)-3-[[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridylidene]methylamino]thiourea CAS Name: 1-(2-ethyl-6-methylphenyl)-3-[[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridinylidene]methylamino]thiourea IUPAC Name: 1-(2-ethyl-6-methylphenyl)-3-[[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]methylamino]thiourea Traditional Name: 1-(2-ethyl-6-methyl-phenyl)-3-[(3-keto-2-methyl-5-methylol-4-pyridylidene)methylamino]thiourea Formula: C18H22N4O2S MolecularWeight: 358.45788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC=C2C(=CN=C(C2=O)C)CO)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC=C2C(=CN=C(C2=O)C)CO)C

InChI

InChI=1S/C18H22N4O2S/c1-4-13-7-5-6-11(2)16(13)21-18(25)22-20-9-15-14(10-23)8-19-12(3)17(15)24/h5-9,20,23H,4,10H2,1-3H3,(H2,21,22,25)