3-[[4-(2,2-dicyanoethenyl)phenyl]carbamoyl]-1-(4-methylphenyl)-1-methylsulfonyl-urea

Systemtic Name: 3-[[4-(2,2-dicyanoethenyl)phenyl]carbamoyl]-1-(4-methylphenyl)-1-methylsulfonyl-urea Openeye Name: 3-[[4-(2,2-dicyanovinyl)phenyl]carbamoyl]-1-methylsulfonyl-1-(p-tolyl)urea CAS Name: 3-[[4-(2,2-dicyanoethenyl)anilino]-oxomethyl]-1-(4-methylphenyl)-1-methylsulfonylurea IUPAC Name: 3-[[4-(2,2-dicyanoethenyl)phenyl]carbamoyl]-1-(4-methylphenyl)-1-methylsulfonylurea Traditional Name: 3-[[4-(2,2-dicyanovinyl)phenyl]carbamoyl]-1-mesyl-1-(p-tolyl)urea Formula: C20H17N5O4S MolecularWeight: 423.44508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C(=O)NC(=O)NC2=CC=C(C=C2)C=C(C#N)C#N)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N(C(=O)NC(=O)NC2=CC=C(C=C2)C=C(C#N)C#N)S(=O)(=O)C

InChI

InChI=1S/C20H17N5O4S/c1-14-3-9-18(10-4-14)25(30(2,28)29)20(27)24-19(26)23-17-7-5-15(6-8-17)11-16(12-21)13-22/h3-11H,1-2H3,(H2,23,24,26,27)