3-(3-chlorophenyl)-1-(3-morpholin-4-ylpropyl)-1-(pyridin-4-ylmethyl)thiourea

Systemtic Name: 3-(3-chlorophenyl)-1-(3-morpholin-4-ylpropyl)-1-(pyridin-4-ylmethyl)thiourea Openeye Name: 3-(3-chlorophenyl)-1-(3-morpholinopropyl)-1-(4-pyridylmethyl)thiourea CAS Name: 3-(3-chlorophenyl)-1-[3-(4-morpholinyl)propyl]-1-(pyridin-4-ylmethyl)thiourea IUPAC Name: 3-(3-chlorophenyl)-1-(3-morpholin-4-ylpropyl)-1-(pyridin-4-ylmethyl)thiourea Traditional Name: 3-(3-chlorophenyl)-1-(3-morpholinopropyl)-1-(4-pyridylmethyl)thiourea Formula: C20H25ClN4OS MolecularWeight: 404.9567

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25ClN4OS/c21-18-3-1-4-19(15-18)23-20(27)25(16-17-5-7-22-8-6-17)10-2-9-24-11-13-26-14-12-24/h1,3-8,15H,2,9-14,16H2,(H,23,27)