1-(2-phenylsulfanylethyl)-3-(3-pyrrolidin-1-ylsulfonylphenyl)thiourea

Systemtic Name: 1-(2-phenylsulfanylethyl)-3-(3-pyrrolidin-1-ylsulfonylphenyl)thiourea Openeye Name: 1-(2-phenylsulfanylethyl)-3-(3-pyrrolidin-1-ylsulfonylphenyl)thiourea CAS Name: 1-[2-(phenylthio)ethyl]-3-[3-(1-pyrrolidinylsulfonyl)phenyl]thiourea IUPAC Name: 1-(2-phenylsulfanylethyl)-3-(3-pyrrolidin-1-ylsulfonylphenyl)thiourea Traditional Name: 1-[2-(phenylthio)ethyl]-3-(3-pyrrolidinosulfonylphenyl)thiourea Formula: C19H23N3O2S3 MolecularWeight: 421.59982

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=S)NCCSC3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=S)NCCSC3=CC=CC=C3

InChI

InChI=1S/C19H23N3O2S3/c23-27(24,22-12-4-5-13-22)18-10-6-7-16(15-18)21-19(25)20-11-14-26-17-8-2-1-3-9-17/h1-3,6-10,15H,4-5,11-14H2,(H2,20,21,25)