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

Systemtic Name: N-[3-[cyclohexyl-(2-methylphenyl)carbonyl-amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[3-[cyclohexyl-(2-methylbenzoyl)amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[3-[cyclohexyl-[(2-methylphenyl)-oxomethyl]amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[3-[cyclohexyl-(2-methylbenzoyl)amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: N-[3-[cyclohexyl(o-toluoyl)amino]propyl]-4-keto-1H-quinazoline-2-carboxamide Formula: C26H30N4O3 MolecularWeight: 446.5414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N(CCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2)C4CCCCC4

Isomeric SMILES

CC1=CC=CC=C1C(=O)N(CCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2)C4CCCCC4

InChI

InChI=1S/C26H30N4O3/c1-18-10-5-6-13-20(18)26(33)30(19-11-3-2-4-12-19)17-9-16-27-25(32)23-28-22-15-8-7-14-21(22)24(31)29-23/h5-8,10,13-15,19H,2-4,9,11-12,16-17H2,1H3,(H,27,32)(H,28,29,31)