4-[[2-azanyl-3-(2-azanyl-2-oxidanylidene-ethyl)-4H-quinazolin-6-yl]oxy]-N-cyclohexyl-N-methyl-butanamide

Systemtic Name: 4-[[2-azanyl-3-(2-azanyl-2-oxidanylidene-ethyl)-4H-quinazolin-6-yl]oxy]-N-cyclohexyl-N-methyl-butanamide Openeye Name: 4-[[2-amino-3-(2-amino-2-oxo-ethyl)-4H-quinazolin-6-yl]oxy]-N-cyclohexyl-N-methyl-butanamide CAS Name: 4-[[2-amino-3-(2-amino-2-oxoethyl)-4H-quinazolin-6-yl]oxy]-N-cyclohexyl-N-methylbutanamide IUPAC Name: 4-[[2-amino-3-(2-amino-2-oxoethyl)-4H-quinazolin-6-yl]oxy]-N-cyclohexyl-N-methylbutanamide Traditional Name: 4-[[2-amino-3-(2-amino-2-keto-ethyl)-4H-quinazolin-6-yl]oxy]-N-cyclohexyl-N-methyl-butyramide Formula: C21H31N5O3 MolecularWeight: 401.50254

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)CCCOC2=CC3=C(C=C2)N=C(N(C3)CC(=O)N)N

Isomeric SMILES

CN(C1CCCCC1)C(=O)CCCOC2=CC3=C(C=C2)N=C(N(C3)CC(=O)N)N

InChI

InChI=1S/C21H31N5O3/c1-25(16-6-3-2-4-7-16)20(28)8-5-11-29-17-9-10-18-15(12-17)13-26(14-19(22)27)21(23)24-18/h9-10,12,16H,2-8,11,13-14H2,1H3,(H2,22,27)(H2,23,24)