1-[(E)-4-(4-methylphenyl)sulfonylbutan-2-ylideneamino]thiourea

Systemtic Name: 1-[(E)-4-(4-methylphenyl)sulfonylbutan-2-ylideneamino]thiourea Openeye Name: [(E)-[1-methyl-3-(p-tolylsulfonyl)propylidene]amino]thiourea CAS Name: [(E)-4-(4-methylphenyl)sulfonylbutan-2-ylideneamino]thiourea IUPAC Name: [(E)-4-(4-methylphenyl)sulfonylbutan-2-ylideneamino]thiourea Traditional Name: [(E)-(1-methyl-3-tosyl-propylidene)amino]thiourea Formula: C12H17N3O2S2 MolecularWeight: 299.41228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=NNC(=S)N)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC/C(=N/NC(=S)N)/C

InChI

InChI=1S/C12H17N3O2S2/c1-9-3-5-11(6-4-9)19(16,17)8-7-10(2)14-15-12(13)18/h3-6H,7-8H2,1-2H3,(H3,13,15,18)/b14-10+