[2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl]-ethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium

Systemtic Name: [2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl]-ethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium Openeye Name: [2-(3-chloro-4-cyano-anilino)-2-oxo-ethyl]-ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: [2-(3-chloro-4-cyanoanilino)-2-oxoethyl]-ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: [2-(3-chloro-4-cyanoanilino)-2-oxoethyl]-ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: [2-(3-chloro-4-cyano-anilino)-2-keto-ethyl]-ethyl-[(4-keto-1H-quinazolin-2-yl)methyl]ammonium Formula: C20H19ClN5O2+ MolecularWeight: 396.85016

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)NC3=CC(=C(C=C3)C#N)Cl

Isomeric SMILES

CC[NH+](CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)NC3=CC(=C(C=C3)C#N)Cl

InChI

InChI=1S/C20H18ClN5O2/c1-2-26(11-18-24-17-6-4-3-5-15(17)20(28)25-18)12-19(27)23-14-8-7-13(10-22)16(21)9-14/h3-9H,2,11-12H2,1H3,(H,23,27)(H,24,25,28)/p+1