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

Systemtic Name: 3-[[4-(2,2-dicyanoethenyl)phenyl]carbamoyl]-1-methylsulfonyl-1-propan-2-yl-urea Openeye Name: 3-[[4-(2,2-dicyanovinyl)phenyl]carbamoyl]-1-isopropyl-1-methylsulfonyl-urea CAS Name: 3-[[4-(2,2-dicyanoethenyl)anilino]-oxomethyl]-1-methylsulfonyl-1-propan-2-ylurea IUPAC Name: 3-[[4-(2,2-dicyanoethenyl)phenyl]carbamoyl]-1-methylsulfonyl-1-propan-2-ylurea Traditional Name: 3-[[4-(2,2-dicyanovinyl)phenyl]carbamoyl]-1-isopropyl-1-mesyl-urea Formula: C16H17N5O4S MolecularWeight: 375.40228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(=O)NC(=O)NC1=CC=C(C=C1)C=C(C#N)C#N)S(=O)(=O)C

Isomeric SMILES

CC(C)N(C(=O)NC(=O)NC1=CC=C(C=C1)C=C(C#N)C#N)S(=O)(=O)C

InChI

InChI=1S/C16H17N5O4S/c1-11(2)21(26(3,24)25)16(23)20-15(22)19-14-6-4-12(5-7-14)8-13(9-17)10-18/h4-8,11H,1-3H3,(H2,19,20,22,23)