2-[(4-aminocarbonylphenyl)methylsulfanyl]-N-[2-[(2-bromophenyl)methylamino]ethyl]-4-methyl-pyrimidine-5-carboxamide

Systemtic Name: 2-[(4-aminocarbonylphenyl)methylsulfanyl]-N-[2-[(2-bromophenyl)methylamino]ethyl]-4-methyl-pyrimidine-5-carboxamide Openeye Name: N-[2-[(2-bromophenyl)methylamino]ethyl]-2-[(4-carbamoylphenyl)methylsulfanyl]-4-methyl-pyrimidine-5-carboxamide CAS Name: N-[2-[(2-bromophenyl)methylamino]ethyl]-2-[(4-carbamoylphenyl)methylthio]-4-methyl-5-pyrimidinecarboxamide IUPAC Name: N-[2-[(2-bromophenyl)methylamino]ethyl]-2-[(4-carbamoylphenyl)methylsulfanyl]-4-methylpyrimidine-5-carboxamide Traditional Name: N-[2-[(2-bromobenzyl)amino]ethyl]-2-[(4-carbamoylbenzyl)thio]-4-methyl-pyrimidine-5-carboxamide Formula: C23H24BrN5O2S MolecularWeight: 514.43796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)NCCNCC2=CC=CC=C2Br)SCC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

CC1=NC(=NC=C1C(=O)NCCNCC2=CC=CC=C2Br)SCC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C23H24BrN5O2S/c1-15-19(22(31)27-11-10-26-12-18-4-2-3-5-20(18)24)13-28-23(29-15)32-14-16-6-8-17(9-7-16)21(25)30/h2-9,13,26H,10-12,14H2,1H3,(H2,25,30)(H,27,31)