1-[4-(cyanomethyl)phenyl]-3-(4-methylphenyl)sulfonyl-urea

Systemtic Name: 1-[4-(cyanomethyl)phenyl]-3-(4-methylphenyl)sulfonyl-urea Openeye Name: 1-[4-(cyanomethyl)phenyl]-3-(p-tolylsulfonyl)urea CAS Name: 1-[4-(cyanomethyl)phenyl]-3-(4-methylphenyl)sulfonylurea IUPAC Name: 1-[4-(cyanomethyl)phenyl]-3-(4-methylphenyl)sulfonylurea Traditional Name: 1-[4-(cyanomethyl)phenyl]-3-tosyl-urea Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O3S/c1-12-2-8-15(9-3-12)23(21,22)19-16(20)18-14-6-4-13(5-7-14)10-11-17/h2-9H,10H2,1H3,(H2,18,19,20)