N-[3-(4-methylpiperazin-1-yl)propyl]-2-(phenylmethyl)-1,3-benzoxazole-6-carboxamide

Systemtic Name: N-[3-(4-methylpiperazin-1-yl)propyl]-2-(phenylmethyl)-1,3-benzoxazole-6-carboxamide Openeye Name: 2-benzyl-N-[3-(4-methylpiperazin-1-yl)propyl]-1,3-benzoxazole-6-carboxamide CAS Name: N-[3-(4-methyl-1-piperazinyl)propyl]-2-(phenylmethyl)-1,3-benzoxazole-6-carboxamide IUPAC Name: 2-benzyl-N-[3-(4-methylpiperazin-1-yl)propyl]-1,3-benzoxazole-6-carboxamide Traditional Name: 2-benzyl-N-[3-(4-methylpiperazino)propyl]-1,3-benzoxazole-6-carboxamide Formula: C23H28N4O2 MolecularWeight: 392.49402

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCNC(=O)C2=CC3=C(C=C2)N=C(O3)CC4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC1)CCCNC(=O)C2=CC3=C(C=C2)N=C(O3)CC4=CC=CC=C4

InChI

InChI=1S/C23H28N4O2/c1-26-12-14-27(15-13-26)11-5-10-24-23(28)19-8-9-20-21(17-19)29-22(25-20)16-18-6-3-2-4-7-18/h2-4,6-9,17H,5,10-16H2,1H3,(H,24,28)