butan-1-ol; N-[3-[(4-butoxyphenyl)carbonyl-methyl-amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide

Systemtic Name: butan-1-ol; N-[3-[(4-butoxyphenyl)carbonyl-methyl-amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: butan-1-ol; N-[3-[(4-butoxybenzoyl)-methyl-amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: 1-butanol; N-[3-[[(4-butoxyphenyl)-oxomethyl]-methylamino]propyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: butan-1-ol; N-[3-[(4-butoxybenzoyl)-methylamino]propyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: butan-1-ol; N-[3-[(4-butoxybenzoyl)-methyl-amino]propyl]-4-keto-1H-quinazoline-2-carboxamide Formula: C36H58N4O7 MolecularWeight: 658.86832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCO.CCCCO.CCCCO.CCCCOC1=CC=C(C=C1)C(=O)N(C)CCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCCCO.CCCCO.CCCCO.CCCCOC1=CC=C(C=C1)C(=O)N(C)CCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C24H28N4O4.3C4H10O/c1-3-4-16-32-18-12-10-17(11-13-18)24(31)28(2)15-7-14-25-23(30)21-26-20-9-6-5-8-19(20)22(29)27-21;3*1-2-3-4-5/h5-6,8-13H,3-4,7,14-16H2,1-2H3,(H,25,30)(H,26,27,29);3*5H,2-4H2,1H3