1-(4-methoxyphenyl)-3-[[1-(thiophen-2-ylmethyl)piperidin-1-ium-4-yl]methyl]thiourea

Systemtic Name: 1-(4-methoxyphenyl)-3-[[1-(thiophen-2-ylmethyl)piperidin-1-ium-4-yl]methyl]thiourea Openeye Name: 1-(4-methoxyphenyl)-3-[[1-(2-thienylmethyl)piperidin-1-ium-4-yl]methyl]thiourea CAS Name: 1-(4-methoxyphenyl)-3-[[1-(thiophen-2-ylmethyl)-4-piperidin-1-iumyl]methyl]thiourea IUPAC Name: 1-(4-methoxyphenyl)-3-[[1-(thiophen-2-ylmethyl)piperidin-1-ium-4-yl]methyl]thiourea Traditional Name: 1-(4-methoxyphenyl)-3-[[1-(2-thenyl)piperidin-1-ium-4-yl]methyl]thiourea Formula: C19H26N3OS2+ MolecularWeight: 376.55924

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NCC2CC[NH+](CC2)CC3=CC=CS3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)NCC2CC[NH+](CC2)CC3=CC=CS3

InChI

InChI=1S/C19H25N3OS2/c1-23-17-6-4-16(5-7-17)21-19(24)20-13-15-8-10-22(11-9-15)14-18-3-2-12-25-18/h2-7,12,15H,8-11,13-14H2,1H3,(H2,20,21,24)/p+1