4-(5-chloranyl-2-methyl-phenyl)-N-[(5-methyl-1,2-benzoxazol-3-yl)methyl]piperazine-1-carboxamide

Systemtic Name: 4-(5-chloranyl-2-methyl-phenyl)-N-[(5-methyl-1,2-benzoxazol-3-yl)methyl]piperazine-1-carboxamide Openeye Name: 4-(5-chloro-2-methyl-phenyl)-N-[(5-methyl-1,2-benzoxazol-3-yl)methyl]piperazine-1-carboxamide CAS Name: 4-(5-chloro-2-methylphenyl)-N-[(5-methyl-1,2-benzoxazol-3-yl)methyl]-1-piperazinecarboxamide IUPAC Name: 4-(5-chloro-2-methylphenyl)-N-[(5-methyl-1,2-benzoxazol-3-yl)methyl]piperazine-1-carboxamide Traditional Name: 4-(5-chloro-2-methyl-phenyl)-N-[(5-methylindoxazen-3-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)ON=C2CNC(=O)N3CCN(CC3)C4=C(C=CC(=C4)Cl)C

Isomeric SMILES

CC1=CC2=C(C=C1)ON=C2CNC(=O)N3CCN(CC3)C4=C(C=CC(=C4)Cl)C

InChI

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