2-(6-tert-butyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]ethanamide

Systemtic Name: 2-(6-tert-butyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]ethanamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-2-(6-tert-butyl-3-oxo-1,4-benzoxazin-4-yl)acetamide CAS Name: 2-(6-tert-butyl-3-oxo-1,4-benzoxazin-4-yl)-N-[2-[4-(phenylmethyl)-1-piperazinyl]ethyl]acetamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-2-(6-tert-butyl-3-oxo-1,4-benzoxazin-4-yl)acetamide Traditional Name: N-[2-(4-benzylpiperazino)ethyl]-2-(6-tert-butyl-3-keto-1,4-benzoxazin-4-yl)acetamide Formula: C27H36N4O3 MolecularWeight: 464.59974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OCC(=O)N2CC(=O)NCCN3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)OCC(=O)N2CC(=O)NCCN3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H36N4O3/c1-27(2,3)22-9-10-24-23(17-22)31(26(33)20-34-24)19-25(32)28-11-12-29-13-15-30(16-14-29)18-21-7-5-4-6-8-21/h4-10,17H,11-16,18-20H2,1-3H3,(H,28,32)