1-methyl-3-[2-[2-(phenylsulfonyl)ethylsulfanyl]ethanoylamino]thiourea

Systemtic Name: 1-methyl-3-[2-[2-(phenylsulfonyl)ethylsulfanyl]ethanoylamino]thiourea Openeye Name: 1-[[2-[2-(benzenesulfonyl)ethylsulfanyl]acetyl]amino]-3-methyl-thiourea CAS Name: 1-[[2-[2-(benzenesulfonyl)ethylthio]-1-oxoethyl]amino]-3-methylthiourea IUPAC Name: 1-[[2-[2-(benzenesulfonyl)ethylsulfanyl]acetyl]amino]-3-methylthiourea Traditional Name: 1-[[2-(2-besylethylthio)acetyl]amino]-3-methyl-thiourea Formula: C12H17N3O3S3 MolecularWeight: 347.47668

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NNC(=O)CSCCS(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CNC(=S)NNC(=O)CSCCS(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C12H17N3O3S3/c1-13-12(19)15-14-11(16)9-20-7-8-21(17,18)10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H,14,16)(H2,13,15,19)