N-[4-[1-[(3-bromophenyl)methoxy]butan-2-ylamino]-6-methyl-1,3,5-triazin-2-yl]propanamide

Systemtic Name: N-[4-[1-[(3-bromophenyl)methoxy]butan-2-ylamino]-6-methyl-1,3,5-triazin-2-yl]propanamide Openeye Name: N-[4-[1-[(3-bromophenyl)methoxymethyl]propylamino]-6-methyl-1,3,5-triazin-2-yl]propanamide CAS Name: N-[4-[1-[(3-bromophenyl)methoxy]butan-2-ylamino]-6-methyl-1,3,5-triazin-2-yl]propanamide IUPAC Name: N-[4-[1-[(3-bromophenyl)methoxy]butan-2-ylamino]-6-methyl-1,3,5-triazin-2-yl]propanamide Traditional Name: N-[4-[1-[(3-bromobenzyl)oxymethyl]propylamino]-6-methyl-s-triazin-2-yl]propionamide Formula: C18H24BrN5O2 MolecularWeight: 422.31946

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COCC1=CC(=CC=C1)Br)NC2=NC(=NC(=N2)NC(=O)CC)C

Isomeric SMILES

CCC(COCC1=CC(=CC=C1)Br)NC2=NC(=NC(=N2)NC(=O)CC)C

InChI

InChI=1S/C18H24BrN5O2/c1-4-15(11-26-10-13-7-6-8-14(19)9-13)22-17-20-12(3)21-18(24-17)23-16(25)5-2/h6-9,15H,4-5,10-11H2,1-3H3,(H2,20,21,22,23,24,25)