N-(6-azanylhexyl)-N-[(1R)-1-(7-chloranyl-3-methyl-4-oxidanylidene-quinazolin-2-yl)ethyl]butanamide

Systemtic Name: N-(6-azanylhexyl)-N-[(1R)-1-(7-chloranyl-3-methyl-4-oxidanylidene-quinazolin-2-yl)ethyl]butanamide Openeye Name: N-(6-aminohexyl)-N-[(1R)-1-(7-chloro-3-methyl-4-oxo-quinazolin-2-yl)ethyl]butanamide CAS Name: N-(6-aminohexyl)-N-[(1R)-1-(7-chloro-3-methyl-4-oxo-2-quinazolinyl)ethyl]butanamide IUPAC Name: N-(6-aminohexyl)-N-[(1R)-1-(7-chloro-3-methyl-4-oxoquinazolin-2-yl)ethyl]butanamide Traditional Name: N-(6-aminohexyl)-N-[(1R)-1-(7-chloro-4-keto-3-methyl-quinazolin-2-yl)ethyl]butyramide Formula: C21H31ClN4O2 MolecularWeight: 406.94944

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(CCCCCCN)C(C)C1=NC2=C(C=CC(=C2)Cl)C(=O)N1C

Isomeric SMILES

CCCC(=O)N(CCCCCCN)[C@H](C)C1=NC2=C(C=CC(=C2)Cl)C(=O)N1C

InChI

InChI=1S/C21H31ClN4O2/c1-4-9-19(27)26(13-8-6-5-7-12-23)15(2)20-24-18-14-16(22)10-11-17(18)21(28)25(20)3/h10-11,14-15H,4-9,12-13,23H2,1-3H3/t15-/m1/s1