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

Systemtic Name: 2-phenethyl-N-[3-(4-phenylpiperazin-1-yl)propyl]-1,3-benzoxazole-6-carboxamide Openeye Name: 2-phenethyl-N-[3-(4-phenylpiperazin-1-yl)propyl]-1,3-benzoxazole-6-carboxamide CAS Name: 2-phenethyl-N-[3-(4-phenyl-1-piperazinyl)propyl]-1,3-benzoxazole-6-carboxamide IUPAC Name: 2-phenethyl-N-[3-(4-phenylpiperazin-1-yl)propyl]-1,3-benzoxazole-6-carboxamide Traditional Name: 2-phenethyl-N-[3-(4-phenylpiperazino)propyl]-1,3-benzoxazole-6-carboxamide Formula: C29H32N4O2 MolecularWeight: 468.58998

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC(=O)C2=CC3=C(C=C2)N=C(O3)CCC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCCNC(=O)C2=CC3=C(C=C2)N=C(O3)CCC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H32N4O2/c34-29(30-16-7-17-32-18-20-33(21-19-32)25-10-5-2-6-11-25)24-13-14-26-27(22-24)35-28(31-26)15-12-23-8-3-1-4-9-23/h1-6,8-11,13-14,22H,7,12,15-21H2,(H,30,34)