2,3-dimethyl-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]quinoxaline-6-carboxamide

Systemtic Name: 2,3-dimethyl-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]quinoxaline-6-carboxamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2,3-dimethyl-quinoxaline-6-carboxamide CAS Name: 2,3-dimethyl-N-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]-6-quinoxalinecarboxamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2,3-dimethylquinoxaline-6-carboxamide Traditional Name: N-[4-(4-benzylpiperazino)phenyl]-2,3-dimethyl-quinoxaline-6-carboxamide Formula: C28H29N5O MolecularWeight: 451.56276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)N4CCN(CC4)CC5=CC=CC=C5)N=C1C

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)N4CCN(CC4)CC5=CC=CC=C5)N=C1C

InChI

InChI=1S/C28H29N5O/c1-20-21(2)30-27-18-23(8-13-26(27)29-20)28(34)31-24-9-11-25(12-10-24)33-16-14-32(15-17-33)19-22-6-4-3-5-7-22/h3-13,18H,14-17,19H2,1-2H3,(H,31,34)