1-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(2-oxidanylpropyl)-3-phenyl-thiourea

Systemtic Name: 1-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(2-oxidanylpropyl)-3-phenyl-thiourea Openeye Name: 1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-hydroxypropyl)-3-phenyl-thiourea CAS Name: 1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-hydroxypropyl)-3-phenylthiourea IUPAC Name: 1-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-hydroxypropyl)-3-phenylthiourea Traditional Name: 1-[(6-ethoxy-2-keto-1H-quinolin-3-yl)methyl]-1-(2-hydroxypropyl)-3-phenyl-thiourea Formula: C22H25N3O3S MolecularWeight: 411.5172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC(C)O)C(=S)NC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC(C)O)C(=S)NC3=CC=CC=C3

InChI

InChI=1S/C22H25N3O3S/c1-3-28-19-9-10-20-16(12-19)11-17(21(27)24-20)14-25(13-15(2)26)22(29)23-18-7-5-4-6-8-18/h4-12,15,26H,3,13-14H2,1-2H3,(H,23,29)(H,24,27)