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

Systemtic Name: 2-(phenylmethyl)-N-[3-(4-phenylpiperazin-1-yl)propyl]-1,3-benzoxazole-6-carboxamide Openeye Name: 2-benzyl-N-[3-(4-phenylpiperazin-1-yl)propyl]-1,3-benzoxazole-6-carboxamide CAS Name: 2-(phenylmethyl)-N-[3-(4-phenyl-1-piperazinyl)propyl]-1,3-benzoxazole-6-carboxamide IUPAC Name: 2-benzyl-N-[3-(4-phenylpiperazin-1-yl)propyl]-1,3-benzoxazole-6-carboxamide Traditional Name: 2-benzyl-N-[3-(4-phenylpiperazino)propyl]-1,3-benzoxazole-6-carboxamide Formula: C28H30N4O2 MolecularWeight: 454.5634

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC(=O)C2=CC3=C(C=C2)N=C(O3)CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCCNC(=O)C2=CC3=C(C=C2)N=C(O3)CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H30N4O2/c33-28(29-14-7-15-31-16-18-32(19-17-31)24-10-5-2-6-11-24)23-12-13-25-26(21-23)34-27(30-25)20-22-8-3-1-4-9-22/h1-6,8-13,21H,7,14-20H2,(H,29,33)