1-[(4,5-dicyano-2-heptyl-phenyl)amino]-3-methyl-urea

Systemtic Name: 1-[(4,5-dicyano-2-heptyl-phenyl)amino]-3-methyl-urea Openeye Name: 1-(4,5-dicyano-2-heptyl-anilino)-3-methyl-urea CAS Name: 1-(4,5-dicyano-2-heptylanilino)-3-methylurea IUPAC Name: 1-(4,5-dicyano-2-heptylanilino)-3-methylurea Traditional Name: 1-(4,5-dicyano-2-heptyl-anilino)-3-methyl-urea Formula: C17H23N5O MolecularWeight: 313.39742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C(C=C(C(=C1)C#N)C#N)NNC(=O)NC

Isomeric SMILES

CCCCCCCC1=C(C=C(C(=C1)C#N)C#N)NNC(=O)NC

InChI

InChI=1S/C17H23N5O/c1-3-4-5-6-7-8-13-9-14(11-18)15(12-19)10-16(13)21-22-17(23)20-2/h9-10,21H,3-8H2,1-2H3,(H2,20,22,23)