1-(3-methylsulfanylphenyl)-3-[[(Z)-N-(phenylsulfonyl)-C-pyrrolidin-1-yl-carbonimidoyl]amino]thiourea

Systemtic Name: 1-(3-methylsulfanylphenyl)-3-[[(Z)-N-(phenylsulfonyl)-C-pyrrolidin-1-yl-carbonimidoyl]amino]thiourea Openeye Name: 1-[[(Z)-N-(benzenesulfonyl)-C-pyrrolidin-1-yl-carbonimidoyl]amino]-3-(3-methylsulfanylphenyl)thiourea CAS Name: 1-[[(Z)-benzenesulfonylimino(1-pyrrolidinyl)methyl]amino]-3-[3-(methylthio)phenyl]thiourea IUPAC Name: 1-[[(Z)-N-(benzenesulfonyl)-C-pyrrolidin-1-ylcarbonimidoyl]amino]-3-(3-methylsulfanylphenyl)thiourea Traditional Name: 1-[[(Z)-N-besyl-C-pyrrolidino-carbonimidoyl]amino]-3-[3-(methylthio)phenyl]thiourea Formula: C19H23N5O2S3 MolecularWeight: 449.61322

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=S)NNC(=NS(=O)(=O)C2=CC=CC=C2)N3CCCC3

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=S)NN/C(=N\S(=O)(=O)C2=CC=CC=C2)/N3CCCC3

InChI

InChI=1S/C19H23N5O2S3/c1-28-16-9-7-8-15(14-16)20-19(27)22-21-18(24-12-5-6-13-24)23-29(25,26)17-10-3-2-4-11-17/h2-4,7-11,14H,5-6,12-13H2,1H3,(H,21,23)(H2,20,22,27)