4-chloranyl-N-[1-[(Z)-[(cyanoamino)-(pyridin-3-ylamino)methylidene]amino]-2,2-dimethyl-pent-4-enyl]benzamide

Systemtic Name: 4-chloranyl-N-[1-[(Z)-[(cyanoamino)-(pyridin-3-ylamino)methylidene]amino]-2,2-dimethyl-pent-4-enyl]benzamide Openeye Name: 4-chloro-N-[1-[(Z)-[(cyanoamino)-(3-pyridylamino)methylene]amino]-2,2-dimethyl-pent-4-enyl]benzamide CAS Name: 4-chloro-N-[1-[(Z)-[(cyanoamino)-(3-pyridinylamino)methylidene]amino]-2,2-dimethylpent-4-enyl]benzamide IUPAC Name: 4-chloro-N-[1-[(Z)-[(cyanoamino)-(pyridin-3-ylamino)methylidene]amino]-2,2-dimethylpent-4-enyl]benzamide Traditional Name: 4-chloro-N-[1-[(Z)-[(cyanoamino)-(3-pyridylamino)methylene]amino]-2,2-dimethyl-pent-4-enyl]benzamide Formula: C21H23ClN6O MolecularWeight: 410.89992

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23ClN6O/c1-4-11-21(2,3)19(27-18(29)15-7-9-16(22)10-8-15)28-20(25-14-23)26-17-6-5-12-24-13-17/h4-10,12-13,19H,1,11H2,2-3H3,(H,27,29)(H2,25,26,28)