1-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)-2-thiophen-2-yl-ethyl]-3-phenethyl-thiourea

Systemtic Name: 1-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)-2-thiophen-2-yl-ethyl]-3-phenethyl-thiourea Openeye Name: 1-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)-2-(2-thienyl)ethyl]-3-phenethyl-thiourea CAS Name: 1-[(2R)-2-(4-methyl-1-piperazin-4-iumyl)-2-thiophen-2-ylethyl]-3-phenethylthiourea IUPAC Name: 1-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)-2-thiophen-2-ylethyl]-3-phenethylthiourea Traditional Name: 1-[(2R)-2-(4-methylpiperazin-4-ium-1-yl)-2-(2-thienyl)ethyl]-3-phenethyl-thiourea Formula: C20H29N4S2+ MolecularWeight: 389.60106

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(CNC(=S)NCCC2=CC=CC=C2)C3=CC=CS3

Isomeric SMILES

C[NH+]1CCN(CC1)[C@H](CNC(=S)NCCC2=CC=CC=C2)C3=CC=CS3

InChI

InChI=1S/C20H28N4S2/c1-23-11-13-24(14-12-23)18(19-8-5-15-26-19)16-22-20(25)21-10-9-17-6-3-2-4-7-17/h2-8,15,18H,9-14,16H2,1H3,(H2,21,22,25)/p+1/t18-/m1/s1