3-(5-chloranyl-2-methoxy-phenyl)-1-[3-(4-methylpiperazin-1-yl)propyl]-1-(thiophen-2-ylmethyl)thiourea

Systemtic Name: 3-(5-chloranyl-2-methoxy-phenyl)-1-[3-(4-methylpiperazin-1-yl)propyl]-1-(thiophen-2-ylmethyl)thiourea Openeye Name: 3-(5-chloro-2-methoxy-phenyl)-1-[3-(4-methylpiperazin-1-yl)propyl]-1-(2-thienylmethyl)thiourea CAS Name: 3-(5-chloro-2-methoxyphenyl)-1-[3-(4-methyl-1-piperazinyl)propyl]-1-(thiophen-2-ylmethyl)thiourea IUPAC Name: 3-(5-chloro-2-methoxyphenyl)-1-[3-(4-methylpiperazin-1-yl)propyl]-1-(thiophen-2-ylmethyl)thiourea Traditional Name: 3-(5-chloro-2-methoxy-phenyl)-1-[3-(4-methylpiperazino)propyl]-1-(2-thenyl)thiourea Formula: C21H29ClN4OS2 MolecularWeight: 453.06416

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCN(CC2=CC=CS2)C(=S)NC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CN1CCN(CC1)CCCN(CC2=CC=CS2)C(=S)NC3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C21H29ClN4OS2/c1-24-10-12-25(13-11-24)8-4-9-26(16-18-5-3-14-29-18)21(28)23-19-15-17(22)6-7-20(19)27-2/h3,5-7,14-15H,4,8-13,16H2,1-2H3,(H,23,28)