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

Systemtic Name: N-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanamide Openeye Name: N-[2-(3-chloro-2-methyl-anilino)-2-oxo-ethyl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide CAS Name: N-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide IUPAC Name: N-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide Traditional Name: N-[2-(3-chloro-2-methyl-anilino)-2-keto-ethyl]-4-(4-keto-1H-quinazolin-2-yl)butyramide Formula: C21H21ClN4O3 MolecularWeight: 412.86944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CNC(=O)CCCC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CNC(=O)CCCC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C21H21ClN4O3/c1-13-15(22)7-4-9-16(13)25-20(28)12-23-19(27)11-5-10-18-24-17-8-3-2-6-14(17)21(29)26-18/h2-4,6-9H,5,10-12H2,1H3,(H,23,27)(H,25,28)(H,24,26,29)