(2S)-N-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-ethyl-2-phenoxy-butanamide

Systemtic Name: (2S)-N-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-ethyl-2-phenoxy-butanamide Openeye Name: (2S)-N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethyl-2-phenoxy-butanamide CAS Name: (2S)-N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethyl-2-phenoxybutanamide IUPAC Name: (2S)-N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethyl-2-phenoxybutanamide Traditional Name: (2S)-N-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl]-N-ethyl-2-phenoxy-butyramide Formula: C21H22ClN3O3 MolecularWeight: 399.87068

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N(CC)CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)OC3=CC=CC=C3

Isomeric SMILES

CC[C@@H](C(=O)N(CC)CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)OC3=CC=CC=C3

InChI

InChI=1S/C21H22ClN3O3/c1-3-18(28-15-8-6-5-7-9-15)21(27)25(4-2)13-19-23-17-12-14(22)10-11-16(17)20(26)24-19/h5-12,18H,3-4,13H2,1-2H3,(H,23,24,26)/t18-/m0/s1