1-[[1-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]-3-(3-methylsulfanylphenyl)thiourea

Systemtic Name: 1-[[1-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]-3-(3-methylsulfanylphenyl)thiourea Openeye Name: 1-[[1-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]-3-(3-methylsulfanylphenyl)thiourea CAS Name: 1-[[1-(4-methoxyphenyl)-3-pyrrolidinyl]methyl]-3-[3-(methylthio)phenyl]thiourea IUPAC Name: 1-[[1-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]-3-(3-methylsulfanylphenyl)thiourea Traditional Name: 1-[[1-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]-3-[3-(methylthio)phenyl]thiourea Formula: C20H25N3OS2 MolecularWeight: 387.562

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCC(C2)CNC(=S)NC3=CC(=CC=C3)SC

Isomeric SMILES

COC1=CC=C(C=C1)N2CCC(C2)CNC(=S)NC3=CC(=CC=C3)SC

InChI

InChI=1S/C20H25N3OS2/c1-24-18-8-6-17(7-9-18)23-11-10-15(14-23)13-21-20(25)22-16-4-3-5-19(12-16)26-2/h3-9,12,15H,10-11,13-14H2,1-2H3,(H2,21,22,25)