1-[(4-chlorophenyl)methyl]-3-(3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)thiourea

Systemtic Name: 1-[(4-chlorophenyl)methyl]-3-(3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)thiourea Openeye Name: 1-[(4-chlorophenyl)methyl]-3-(3-morpholinopropyl)-1-(2-pyridylmethyl)thiourea CAS Name: 1-[(4-chlorophenyl)methyl]-3-[3-(4-morpholinyl)propyl]-1-(2-pyridinylmethyl)thiourea IUPAC Name: 1-[(4-chlorophenyl)methyl]-3-(3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)thiourea Traditional Name: 1-(4-chlorobenzyl)-3-(3-morpholinopropyl)-1-(2-pyridylmethyl)thiourea Formula: C21H27ClN4OS MolecularWeight: 418.98328

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC(=S)N(CC2=CC=C(C=C2)Cl)CC3=CC=CC=N3

Isomeric SMILES

C1COCCN1CCCNC(=S)N(CC2=CC=C(C=C2)Cl)CC3=CC=CC=N3

InChI

InChI=1S/C21H27ClN4OS/c22-19-7-5-18(6-8-19)16-26(17-20-4-1-2-9-23-20)21(28)24-10-3-11-25-12-14-27-15-13-25/h1-2,4-9H,3,10-17H2,(H,24,28)