2-(1,3-benzoxazol-2-ylamino)-N-[(2-chlorophenyl)methyl]-4-methyl-pyrimidine-5-carboxamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylamino)-N-[(2-chlorophenyl)methyl]-4-methyl-pyrimidine-5-carboxamide Openeye Name: 2-(1,3-benzoxazol-2-ylamino)-N-[(2-chlorophenyl)methyl]-4-methyl-pyrimidine-5-carboxamide CAS Name: 2-(1,3-benzoxazol-2-ylamino)-N-[(2-chlorophenyl)methyl]-4-methyl-5-pyrimidinecarboxamide IUPAC Name: 2-(1,3-benzoxazol-2-ylamino)-N-[(2-chlorophenyl)methyl]-4-methylpyrimidine-5-carboxamide Traditional Name: 2-(1,3-benzoxazol-2-ylamino)-N-(2-chlorobenzyl)-4-methyl-pyrimidine-5-carboxamide Formula: C20H16ClN5O2 MolecularWeight: 393.82634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)NCC2=CC=CC=C2Cl)NC3=NC4=CC=CC=C4O3

Isomeric SMILES

CC1=NC(=NC=C1C(=O)NCC2=CC=CC=C2Cl)NC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C20H16ClN5O2/c1-12-14(18(27)22-10-13-6-2-3-7-15(13)21)11-23-19(24-12)26-20-25-16-8-4-5-9-17(16)28-20/h2-9,11H,10H2,1H3,(H,22,27)(H,23,24,25,26)