1-[(5-chloranyl-2-oxidanyl-phenyl)methyl]-1-(3-morpholin-4-ylpropyl)-3-phenyl-thiourea

Systemtic Name: 1-[(5-chloranyl-2-oxidanyl-phenyl)methyl]-1-(3-morpholin-4-ylpropyl)-3-phenyl-thiourea Openeye Name: 1-[(5-chloro-2-hydroxy-phenyl)methyl]-1-(3-morpholinopropyl)-3-phenyl-thiourea CAS Name: 1-[(5-chloro-2-hydroxyphenyl)methyl]-1-[3-(4-morpholinyl)propyl]-3-phenylthiourea IUPAC Name: 1-[(5-chloro-2-hydroxyphenyl)methyl]-1-(3-morpholin-4-ylpropyl)-3-phenylthiourea Traditional Name: 1-(5-chloro-2-hydroxy-benzyl)-1-(3-morpholinopropyl)-3-phenyl-thiourea Formula: C21H26ClN3O2S MolecularWeight: 419.96804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCN(CC2=C(C=CC(=C2)Cl)O)C(=S)NC3=CC=CC=C3

Isomeric SMILES

C1COCCN1CCCN(CC2=C(C=CC(=C2)Cl)O)C(=S)NC3=CC=CC=C3

InChI

InChI=1S/C21H26ClN3O2S/c22-18-7-8-20(26)17(15-18)16-25(10-4-9-24-11-13-27-14-12-24)21(28)23-19-5-2-1-3-6-19/h1-3,5-8,15,26H,4,9-14,16H2,(H,23,28)