N-(2-chloranyl-4-methyl-phenyl)-4-[(6-methyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-carboxamide

Systemtic Name: N-(2-chloranyl-4-methyl-phenyl)-4-[(6-methyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-carboxamide Openeye Name: N-(2-chloro-4-methyl-phenyl)-4-[(6-methyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-carboxamide CAS Name: N-(2-chloro-4-methylphenyl)-4-[(6-methyl-1,3-benzoxazol-2-yl)methyl]-1-piperazinecarboxamide IUPAC Name: N-(2-chloro-4-methylphenyl)-4-[(6-methyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-carboxamide Traditional Name: N-(2-chloro-4-methyl-phenyl)-4-[(6-methyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-carboxamide Formula: C21H23ClN4O2 MolecularWeight: 398.88592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(O2)CN3CCN(CC3)C(=O)NC4=C(C=C(C=C4)C)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(O2)CN3CCN(CC3)C(=O)NC4=C(C=C(C=C4)C)Cl

InChI

InChI=1S/C21H23ClN4O2/c1-14-3-5-17(16(22)11-14)24-21(27)26-9-7-25(8-10-26)13-20-23-18-6-4-15(2)12-19(18)28-20/h3-6,11-12H,7-10,13H2,1-2H3,(H,24,27)