4-chloranyl-N-[1-[(E)-[(cyanoamino)-(pyridin-3-ylamino)methylidene]amino]-4-(dimethylamino)-2,2-dimethyl-butyl]benzamide

Systemtic Name: 4-chloranyl-N-[1-[(E)-[(cyanoamino)-(pyridin-3-ylamino)methylidene]amino]-4-(dimethylamino)-2,2-dimethyl-butyl]benzamide Openeye Name: 4-chloro-N-[1-[(E)-[(cyanoamino)-(3-pyridylamino)methylene]amino]-4-(dimethylamino)-2,2-dimethyl-butyl]benzamide CAS Name: 4-chloro-N-[1-[(E)-[(cyanoamino)-(3-pyridinylamino)methylidene]amino]-4-(dimethylamino)-2,2-dimethylbutyl]benzamide IUPAC Name: 4-chloro-N-[1-[(E)-[(cyanoamino)-(pyridin-3-ylamino)methylidene]amino]-4-(dimethylamino)-2,2-dimethylbutyl]benzamide Traditional Name: 4-chloro-N-[1-[(E)-[(cyanoamino)-(3-pyridylamino)methylene]amino]-4-(dimethylamino)-2,2-dimethyl-butyl]benzamide Formula: C22H28ClN7O MolecularWeight: 441.95702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCN(C)C)C(NC(=O)C1=CC=C(C=C1)Cl)N=C(NC#N)NC2=CN=CC=C2

Isomeric SMILES

CC(C)(CCN(C)C)C(NC(=O)C1=CC=C(C=C1)Cl)/N=C(/NC#N)\NC2=CN=CC=C2

InChI

InChI=1S/C22H28ClN7O/c1-22(2,11-13-30(3)4)20(28-19(31)16-7-9-17(23)10-8-16)29-21(26-15-24)27-18-6-5-12-25-14-18/h5-10,12,14,20H,11,13H2,1-4H3,(H,28,31)(H2,26,27,29)