3-(5-chloranyl-2-methyl-phenyl)-1-(3-morpholin-4-ylpropyl)-1-(phenylmethyl)thiourea

Systemtic Name: 3-(5-chloranyl-2-methyl-phenyl)-1-(3-morpholin-4-ylpropyl)-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-(5-chloro-2-methyl-phenyl)-1-(3-morpholinopropyl)thiourea CAS Name: 3-(5-chloro-2-methylphenyl)-1-[3-(4-morpholinyl)propyl]-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-(5-chloro-2-methylphenyl)-1-(3-morpholin-4-ylpropyl)thiourea Traditional Name: 1-benzyl-3-(5-chloro-2-methyl-phenyl)-1-(3-morpholinopropyl)thiourea Formula: C22H28ClN3OS MolecularWeight: 417.99522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=S)N(CCCN2CCOCC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=S)N(CCCN2CCOCC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H28ClN3OS/c1-18-8-9-20(23)16-21(18)24-22(28)26(17-19-6-3-2-4-7-19)11-5-10-25-12-14-27-15-13-25/h2-4,6-9,16H,5,10-15,17H2,1H3,(H,24,28)