phenyl N'-cyano-N-methyl-N-(2,3,4,5,6-pentamethylphenyl)carbamimidate

Systemtic Name: phenyl N'-cyano-N-methyl-N-(2,3,4,5,6-pentamethylphenyl)carbamimidate Openeye Name: 3-cyano-1-methyl-1-(2,3,4,5,6-pentamethylphenyl)-2-phenyl-isourea CAS Name: N'-cyano-N-methyl-N-(2,3,4,5,6-pentamethylphenyl)carbamimidic acid phenyl ester IUPAC Name: phenyl N'-cyano-N-methyl-N-(2,3,4,5,6-pentamethylphenyl)carbamimidate Traditional Name: 3-cyano-1-methyl-1-(2,3,4,5,6-pentamethylphenyl)-2-phenyl-isourea Formula: C20H23N3O MolecularWeight: 321.41612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)N(C)C(=NC#N)OC2=CC=CC=C2)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)N(C)C(=NC#N)OC2=CC=CC=C2)C)C

InChI

InChI=1S/C20H23N3O/c1-13-14(2)16(4)19(17(5)15(13)3)23(6)20(22-12-21)24-18-10-8-7-9-11-18/h7-11H,1-6H3