2-[(6-tert-butyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]-N-[1-(phenylmethyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[(6-tert-butyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]-N-[1-(phenylmethyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Openeye Name: N-(1-benzyl-4-piperidyl)-2-[(6-tert-butyl-3-oxo-1,4-benzoxazin-4-yl)methyl]thiazole-4-carboxamide CAS Name: 2-[(6-tert-butyl-3-oxo-1,4-benzoxazin-4-yl)methyl]-N-[1-(phenylmethyl)-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-2-[(6-tert-butyl-3-oxo-1,4-benzoxazin-4-yl)methyl]-1,3-thiazole-4-carboxamide Traditional Name: N-(1-benzyl-4-piperidyl)-2-[(6-tert-butyl-3-keto-1,4-benzoxazin-4-yl)methyl]thiazole-4-carboxamide Formula: C29H34N4O3S MolecularWeight: 518.67026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OCC(=O)N2CC3=NC(=CS3)C(=O)NC4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)OCC(=O)N2CC3=NC(=CS3)C(=O)NC4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C29H34N4O3S/c1-29(2,3)21-9-10-25-24(15-21)33(27(34)18-36-25)17-26-31-23(19-37-26)28(35)30-22-11-13-32(14-12-22)16-20-7-5-4-6-8-20/h4-10,15,19,22H,11-14,16-18H2,1-3H3,(H,30,35)