N-[(4-chlorophenyl)methyl]-6-(3,4-dihydro-2H-quinolin-1-yl)-5-nitro-pyrimidin-4-amine

Systemtic Name: N-[(4-chlorophenyl)methyl]-6-(3,4-dihydro-2H-quinolin-1-yl)-5-nitro-pyrimidin-4-amine Openeye Name: N-[(4-chlorophenyl)methyl]-6-(3,4-dihydro-2H-quinolin-1-yl)-5-nitro-pyrimidin-4-amine CAS Name: N-[(4-chlorophenyl)methyl]-6-(3,4-dihydro-2H-quinolin-1-yl)-5-nitro-4-pyrimidinamine IUPAC Name: N-[(4-chlorophenyl)methyl]-6-(3,4-dihydro-2H-quinolin-1-yl)-5-nitropyrimidin-4-amine Traditional Name: (4-chlorobenzyl)-[6-(3,4-dihydro-2H-quinolin-1-yl)-5-nitro-pyrimidin-4-yl]amine Formula: C20H18ClN5O2 MolecularWeight: 395.84222

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)C3=C(C(=NC=N3)NCC4=CC=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)C3=C(C(=NC=N3)NCC4=CC=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H18ClN5O2/c21-16-9-7-14(8-10-16)12-22-19-18(26(27)28)20(24-13-23-19)25-11-3-5-15-4-1-2-6-17(15)25/h1-2,4,6-10,13H,3,5,11-12H2,(H,22,23,24)