N-(2-azanylethyl)-N-[1-[7-chloranyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]propyl]prop-2-enamide

Systemtic Name: N-(2-azanylethyl)-N-[1-[7-chloranyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]propyl]prop-2-enamide Openeye Name: N-(2-aminoethyl)-N-[1-(3-benzyl-7-chloro-4-oxo-quinazolin-2-yl)propyl]prop-2-enamide CAS Name: N-(2-aminoethyl)-N-[1-[7-chloro-4-oxo-3-(phenylmethyl)-2-quinazolinyl]propyl]-2-propenamide IUPAC Name: N-(2-aminoethyl)-N-[1-(3-benzyl-7-chloro-4-oxoquinazolin-2-yl)propyl]prop-2-enamide Traditional Name: N-(2-aminoethyl)-N-[1-(3-benzyl-7-chloro-4-keto-quinazolin-2-yl)propyl]acrylamide Formula: C23H25ClN4O2 MolecularWeight: 424.9232

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC3=CC=CC=C3)N(CCN)C(=O)C=C

Isomeric SMILES

CCC(C1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC3=CC=CC=C3)N(CCN)C(=O)C=C

InChI

InChI=1S/C23H25ClN4O2/c1-3-20(27(13-12-25)21(29)4-2)22-26-19-14-17(24)10-11-18(19)23(30)28(22)15-16-8-6-5-7-9-16/h4-11,14,20H,2-3,12-13,15,25H2,1H3