1-[3-(4-methylpiperazin-1-yl)propyl]-3-(4-phenoxyphenyl)-1-(thiophen-2-ylmethyl)thiourea

Systemtic Name: 1-[3-(4-methylpiperazin-1-yl)propyl]-3-(4-phenoxyphenyl)-1-(thiophen-2-ylmethyl)thiourea Openeye Name: 1-[3-(4-methylpiperazin-1-yl)propyl]-3-(4-phenoxyphenyl)-1-(2-thienylmethyl)thiourea CAS Name: 1-[3-(4-methyl-1-piperazinyl)propyl]-3-(4-phenoxyphenyl)-1-(thiophen-2-ylmethyl)thiourea IUPAC Name: 1-[3-(4-methylpiperazin-1-yl)propyl]-3-(4-phenoxyphenyl)-1-(thiophen-2-ylmethyl)thiourea Traditional Name: 1-[3-(4-methylpiperazino)propyl]-3-(4-phenoxyphenyl)-1-(2-thenyl)thiourea Formula: C26H32N4OS2 MolecularWeight: 480.68848

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCN(CC2=CC=CS2)C(=S)NC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC1)CCCN(CC2=CC=CS2)C(=S)NC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C26H32N4OS2/c1-28-16-18-29(19-17-28)14-6-15-30(21-25-9-5-20-33-25)26(32)27-22-10-12-24(13-11-22)31-23-7-3-2-4-8-23/h2-5,7-13,20H,6,14-19,21H2,1H3,(H,27,32)