1-(4-methoxyphenyl)-3-[(2R)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]thiourea

Systemtic Name: 1-(4-methoxyphenyl)-3-[(2R)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]thiourea Openeye Name: 1-(4-methoxyphenyl)-3-[(2R)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]thiourea CAS Name: 1-(4-methoxyphenyl)-3-[(2R)-2-(1-pyrrolidin-1-iumyl)-2-thiophen-2-ylethyl]thiourea IUPAC Name: 1-(4-methoxyphenyl)-3-[(2R)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-ylethyl]thiourea Traditional Name: 1-(4-methoxyphenyl)-3-[(2R)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]thiourea Formula: C18H24N3OS2+ MolecularWeight: 362.53266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NCC(C2=CC=CS2)[NH+]3CCCC3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)NC[C@H](C2=CC=CS2)[NH+]3CCCC3

InChI

InChI=1S/C18H23N3OS2/c1-22-15-8-6-14(7-9-15)20-18(23)19-13-16(17-5-4-12-24-17)21-10-2-3-11-21/h4-9,12,16H,2-3,10-11,13H2,1H3,(H2,19,20,23)/p+1/t16-/m1/s1