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

Systemtic Name: N-(6-azanylhexyl)-N-[1-(7-chloranyl-3-methyl-4-oxidanylidene-quinazolin-2-yl)ethyl]-2-phenyl-butanamide Openeye Name: N-(6-aminohexyl)-N-[1-(7-chloro-3-methyl-4-oxo-quinazolin-2-yl)ethyl]-2-phenyl-butanamide CAS Name: N-(6-aminohexyl)-N-[1-(7-chloro-3-methyl-4-oxo-2-quinazolinyl)ethyl]-2-phenylbutanamide IUPAC Name: N-(6-aminohexyl)-N-[1-(7-chloro-3-methyl-4-oxoquinazolin-2-yl)ethyl]-2-phenylbutanamide Traditional Name: N-(6-aminohexyl)-N-[1-(7-chloro-4-keto-3-methyl-quinazolin-2-yl)ethyl]-2-phenyl-butyramide Formula: C27H35ClN4O2 MolecularWeight: 483.0454

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)N(CCCCCCN)C(C)C2=NC3=C(C=CC(=C3)Cl)C(=O)N2C

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)N(CCCCCCN)C(C)C2=NC3=C(C=CC(=C3)Cl)C(=O)N2C

InChI

InChI=1S/C27H35ClN4O2/c1-4-22(20-12-8-7-9-13-20)27(34)32(17-11-6-5-10-16-29)19(2)25-30-24-18-21(28)14-15-23(24)26(33)31(25)3/h7-9,12-15,18-19,22H,4-6,10-11,16-17,29H2,1-3H3