6-methyl-2-[(2-methyl-6-nitro-phenyl)amino]-4-(trifluoromethyl)-6,7,8,8a-tetrahydro-5H-quinazoline-1-carboxamide

Systemtic Name: 6-methyl-2-[(2-methyl-6-nitro-phenyl)amino]-4-(trifluoromethyl)-6,7,8,8a-tetrahydro-5H-quinazoline-1-carboxamide Openeye Name: 6-methyl-2-(2-methyl-6-nitro-anilino)-4-(trifluoromethyl)-6,7,8,8a-tetrahydro-5H-quinazoline-1-carboxamide CAS Name: 6-methyl-2-(2-methyl-6-nitroanilino)-4-(trifluoromethyl)-6,7,8,8a-tetrahydro-5H-quinazoline-1-carboxamide IUPAC Name: 6-methyl-2-(2-methyl-6-nitroanilino)-4-(trifluoromethyl)-6,7,8,8a-tetrahydro-5H-quinazoline-1-carboxamide Traditional Name: 6-methyl-2-(2-methyl-6-nitro-anilino)-4-(trifluoromethyl)-6,7,8,8a-tetrahydro-5H-quinazoline-1-carboxamide Formula: C18H20F3N5O3 MolecularWeight: 411.37831

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2C(=C(N=C(N2C(=O)N)NC3=C(C=CC=C3[N+](=O)[O-])C)C(F)(F)F)C1

Isomeric SMILES

CC1CCC2C(=C(N=C(N2C(=O)N)NC3=C(C=CC=C3[N+](=O)[O-])C)C(F)(F)F)C1

InChI

InChI=1S/C18H20F3N5O3/c1-9-6-7-12-11(8-9)15(18(19,20)21)24-17(25(12)16(22)27)23-14-10(2)4-3-5-13(14)26(28)29/h3-5,9,12H,6-8H2,1-2H3,(H2,22,27)(H,23,24)