1-methyl-3-(2-phenylsulfanylethyl)-1-[(2-pyrrolidin-1-ylphenyl)methyl]thiourea

Systemtic Name: 1-methyl-3-(2-phenylsulfanylethyl)-1-[(2-pyrrolidin-1-ylphenyl)methyl]thiourea Openeye Name: 1-methyl-3-(2-phenylsulfanylethyl)-1-[(2-pyrrolidin-1-ylphenyl)methyl]thiourea CAS Name: 1-methyl-3-[2-(phenylthio)ethyl]-1-[[2-(1-pyrrolidinyl)phenyl]methyl]thiourea IUPAC Name: 1-methyl-3-(2-phenylsulfanylethyl)-1-[(2-pyrrolidin-1-ylphenyl)methyl]thiourea Traditional Name: 1-methyl-3-[2-(phenylthio)ethyl]-1-(2-pyrrolidinobenzyl)thiourea Formula: C21H27N3S2 MolecularWeight: 385.58918

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1N2CCCC2)C(=S)NCCSC3=CC=CC=C3

Isomeric SMILES

CN(CC1=CC=CC=C1N2CCCC2)C(=S)NCCSC3=CC=CC=C3

InChI

InChI=1S/C21H27N3S2/c1-23(21(25)22-13-16-26-19-10-3-2-4-11-19)17-18-9-5-6-12-20(18)24-14-7-8-15-24/h2-6,9-12H,7-8,13-17H2,1H3,(H,22,25)