1-[2-cyano-2-(4-methylphenyl)sulfonyl-ethenyl]-3-(2-methoxyphenyl)thiourea

Systemtic Name: 1-[2-cyano-2-(4-methylphenyl)sulfonyl-ethenyl]-3-(2-methoxyphenyl)thiourea Openeye Name: 1-[2-cyano-2-(p-tolylsulfonyl)vinyl]-3-(2-methoxyphenyl)thiourea CAS Name: 1-[2-cyano-2-(4-methylphenyl)sulfonylethenyl]-3-(2-methoxyphenyl)thiourea IUPAC Name: 1-[2-cyano-2-(4-methylphenyl)sulfonylethenyl]-3-(2-methoxyphenyl)thiourea Traditional Name: 1-(2-cyano-2-tosyl-vinyl)-3-(2-methoxyphenyl)thiourea Formula: C18H17N3O3S2 MolecularWeight: 387.47588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CNC(=S)NC2=CC=CC=C2OC)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(=CNC(=S)NC2=CC=CC=C2OC)C#N

InChI

InChI=1S/C18H17N3O3S2/c1-13-7-9-14(10-8-13)26(22,23)15(11-19)12-20-18(25)21-16-5-3-4-6-17(16)24-2/h3-10,12H,1-2H3,(H2,20,21,25)