N4-(2-bromanyl-4-propan-2-yl-phenyl)-N2-cyclopropyl-N4-ethyl-6-methyl-N2-prop-2-enyl-1,3,5-triazine-2,4-diamine

Systemtic Name: N4-(2-bromanyl-4-propan-2-yl-phenyl)-N2-cyclopropyl-N4-ethyl-6-methyl-N2-prop-2-enyl-1,3,5-triazine-2,4-diamine Openeye Name: N2-allyl-N4-(2-bromo-4-isopropyl-phenyl)-N2-cyclopropyl-N4-ethyl-6-methyl-1,3,5-triazine-2,4-diamine CAS Name: N4-(2-bromo-4-propan-2-ylphenyl)-N2-cyclopropyl-N4-ethyl-6-methyl-N2-prop-2-enyl-1,3,5-triazine-2,4-diamine IUPAC Name: 4-N-(2-bromo-4-propan-2-ylphenyl)-2-N-cyclopropyl-4-N-ethyl-6-methyl-2-N-prop-2-enyl-1,3,5-triazine-2,4-diamine Traditional Name: allyl-[4-(2-bromo-N-ethyl-4-isopropyl-anilino)-6-methyl-s-triazin-2-yl]-cyclopropyl-amine Formula: C21H28BrN5 MolecularWeight: 430.38452

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(C=C(C=C1)C(C)C)Br)C2=NC(=NC(=N2)C)N(CC=C)C3CC3

Isomeric SMILES

CCN(C1=C(C=C(C=C1)C(C)C)Br)C2=NC(=NC(=N2)C)N(CC=C)C3CC3

InChI

InChI=1S/C21H28BrN5/c1-6-12-27(17-9-10-17)21-24-15(5)23-20(25-21)26(7-2)19-11-8-16(14(3)4)13-18(19)22/h6,8,11,13-14,17H,1,7,9-10,12H2,2-5H3