1-(3-methoxyphenyl)-3-[(2R)-2-(4-methylpiperazine-1,4-diium-1-yl)-2-thiophen-2-yl-ethyl]thiourea

Systemtic Name: 1-(3-methoxyphenyl)-3-[(2R)-2-(4-methylpiperazine-1,4-diium-1-yl)-2-thiophen-2-yl-ethyl]thiourea Openeye Name: 1-(3-methoxyphenyl)-3-[(2R)-2-(4-methylpiperazine-1,4-diium-1-yl)-2-(2-thienyl)ethyl]thiourea CAS Name: 1-(3-methoxyphenyl)-3-[(2R)-2-(4-methyl-1-piperazine-1,4-diiumyl)-2-thiophen-2-ylethyl]thiourea IUPAC Name: 1-(3-methoxyphenyl)-3-[(2R)-2-(4-methylpiperazine-1,4-diium-1-yl)-2-thiophen-2-ylethyl]thiourea Traditional Name: 1-(3-methoxyphenyl)-3-[(2R)-2-(4-methylpiperazine-1,4-diium-1-yl)-2-(2-thienyl)ethyl]thiourea Formula: C19H28N4OS2+2 MolecularWeight: 392.58182

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)C(CNC(=S)NC2=CC(=CC=C2)OC)C3=CC=CS3

Isomeric SMILES

C[NH+]1CC[NH+](CC1)[C@H](CNC(=S)NC2=CC(=CC=C2)OC)C3=CC=CS3

InChI

InChI=1S/C19H26N4OS2/c1-22-8-10-23(11-9-22)17(18-7-4-12-26-18)14-20-19(25)21-15-5-3-6-16(13-15)24-2/h3-7,12-13,17H,8-11,14H2,1-2H3,(H2,20,21,25)/p+2/t17-/m1/s1