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

Systemtic Name: 1-[(4-chlorophenyl)methyl]-3-(3-morpholin-4-ylpropyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-[(4-chlorophenyl)methyl]-3-(3-morpholinopropyl)-1-(3-pyridylmethyl)thiourea CAS Name: 1-[(4-chlorophenyl)methyl]-3-[3-(4-morpholinyl)propyl]-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-[(4-chlorophenyl)methyl]-3-(3-morpholin-4-ylpropyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-(4-chlorobenzyl)-3-(3-morpholinopropyl)-1-(3-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=CN=CC=C3

Isomeric SMILES

C1COCCN1CCCNC(=S)N(CC2=CC=C(C=C2)Cl)CC3=CN=CC=C3

InChI

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