N-[3-[cyclohexyl-(3,4,5-triethoxyphenyl)carbonyl-amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide

Systemtic Name: N-[3-[cyclohexyl-(3,4,5-triethoxyphenyl)carbonyl-amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[3-[cyclohexyl-(3,4,5-triethoxybenzoyl)amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[3-[cyclohexyl-[oxo-(3,4,5-triethoxyphenyl)methyl]amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[3-[cyclohexyl-(3,4,5-triethoxybenzoyl)amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: N-[3-[cyclohexyl-(3,4,5-triethoxybenzoyl)amino]propyl]-4-keto-1H-quinazoline-2-carboxamide Formula: C31H40N4O6 MolecularWeight: 564.6725

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N(CCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2)C4CCCCC4

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N(CCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2)C4CCCCC4

InChI

InChI=1S/C31H40N4O6/c1-4-39-25-19-21(20-26(40-5-2)27(25)41-6-3)31(38)35(22-13-8-7-9-14-22)18-12-17-32-30(37)28-33-24-16-11-10-15-23(24)29(36)34-28/h10-11,15-16,19-20,22H,4-9,12-14,17-18H2,1-3H3,(H,32,37)(H,33,34,36)