N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-4-(6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl)butanamide

Systemtic Name: N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-4-(6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl)butanamide Openeye Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-4-(6,7-dimethoxy-4-oxo-quinazolin-3-yl)butanamide CAS Name: N-[3-chloro-4-(3-oxo-1-piperazinyl)phenyl]-4-(6,7-dimethoxy-4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-4-(6,7-dimethoxy-4-oxoquinazolin-3-yl)butanamide Traditional Name: N-[3-chloro-4-(3-ketopiperazino)phenyl]-4-(4-keto-6,7-dimethoxy-quinazolin-3-yl)butyramide Formula: C24H26ClN5O5 MolecularWeight: 499.94674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N(C=N2)CCCC(=O)NC3=CC(=C(C=C3)N4CCNC(=O)C4)Cl)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N(C=N2)CCCC(=O)NC3=CC(=C(C=C3)N4CCNC(=O)C4)Cl)OC

InChI

InChI=1S/C24H26ClN5O5/c1-34-20-11-16-18(12-21(20)35-2)27-14-30(24(16)33)8-3-4-22(31)28-15-5-6-19(17(25)10-15)29-9-7-26-23(32)13-29/h5-6,10-12,14H,3-4,7-9,13H2,1-2H3,(H,26,32)(H,28,31)