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

Systemtic Name: N-[3-[cyclohexyl-(3-methylphenyl)carbonyl-amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[3-[cyclohexyl-(3-methylbenzoyl)amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[3-[cyclohexyl-[(3-methylphenyl)-oxomethyl]amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[3-[cyclohexyl-(3-methylbenzoyl)amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: N-[3-[cyclohexyl(m-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(=C1)C(=O)N(CCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2)C4CCCCC4

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N(CCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2)C4CCCCC4

InChI

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