3-(4-chloranyl-2-methoxy-phenyl)-1-(1-ethanoylpiperidin-4-yl)-1-(2-morpholin-4-ylethyl)thiourea

Systemtic Name: 3-(4-chloranyl-2-methoxy-phenyl)-1-(1-ethanoylpiperidin-4-yl)-1-(2-morpholin-4-ylethyl)thiourea Openeye Name: 1-(1-acetyl-4-piperidyl)-3-(4-chloro-2-methoxy-phenyl)-1-(2-morpholinoethyl)thiourea CAS Name: 1-(1-acetyl-4-piperidinyl)-3-(4-chloro-2-methoxyphenyl)-1-[2-(4-morpholinyl)ethyl]thiourea IUPAC Name: 1-(1-acetylpiperidin-4-yl)-3-(4-chloro-2-methoxyphenyl)-1-(2-morpholin-4-ylethyl)thiourea Traditional Name: 1-(1-acetyl-4-piperidyl)-3-(4-chloro-2-methoxy-phenyl)-1-(2-morpholinoethyl)thiourea Formula: C21H31ClN4O3S MolecularWeight: 455.01384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)N(CCN2CCOCC2)C(=S)NC3=C(C=C(C=C3)Cl)OC

Isomeric SMILES

CC(=O)N1CCC(CC1)N(CCN2CCOCC2)C(=S)NC3=C(C=C(C=C3)Cl)OC

InChI

InChI=1S/C21H31ClN4O3S/c1-16(27)25-7-5-18(6-8-25)26(10-9-24-11-13-29-14-12-24)21(30)23-19-4-3-17(22)15-20(19)28-2/h3-4,15,18H,5-14H2,1-2H3,(H,23,30)