(2R)-2-(1,2,3-benzothiadiazol-6-yl)-N-tert-butyl-2-[(2R,5R)-5-(2,3-dihydro-1H-inden-2-yl)-2-(2-methylpropyl)-3,6-bis(oxidanylidene)piperazin-1-yl]ethanamide

Systemtic Name: (2R)-2-(1,2,3-benzothiadiazol-6-yl)-N-tert-butyl-2-[(2R,5R)-5-(2,3-dihydro-1H-inden-2-yl)-2-(2-methylpropyl)-3,6-bis(oxidanylidene)piperazin-1-yl]ethanamide Openeye Name: (2R)-2-(1,2,3-benzothiadiazol-6-yl)-N-tert-butyl-2-[(2R,5R)-5-indan-2-yl-2-isobutyl-3,6-dioxo-piperazin-1-yl]acetamide CAS Name: (2R)-2-(1,2,3-benzothiadiazol-6-yl)-N-tert-butyl-2-[(2R,5R)-5-(2,3-dihydro-1H-inden-2-yl)-2-(2-methylpropyl)-3,6-dioxo-1-piperazinyl]acetamide IUPAC Name: (2R)-2-(1,2,3-benzothiadiazol-6-yl)-N-tert-butyl-2-[(2R,5R)-5-(2,3-dihydro-1H-inden-2-yl)-2-(2-methylpropyl)-3,6-dioxopiperazin-1-yl]acetamide Traditional Name: (2R)-2-(1,2,3-benzothiadiazol-6-yl)-N-tert-butyl-2-[(2R,5R)-5-indan-2-yl-2-isobutyl-3,6-diketo-piperazino]acetamide Formula: C29H35N5O3S MolecularWeight: 533.6849

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C(=O)NC(C(=O)N1C(C2=CC3=C(C=C2)N=NS3)C(=O)NC(C)(C)C)C4CC5=CC=CC=C5C4

Isomeric SMILES

CC(C)C[C@@H]1C(=O)N[C@@H](C(=O)N1[C@H](C2=CC3=C(C=C2)N=NS3)C(=O)NC(C)(C)C)C4CC5=CC=CC=C5C4

InChI

InChI=1S/C29H35N5O3S/c1-16(2)12-22-26(35)30-24(20-13-17-8-6-7-9-18(17)14-20)28(37)34(22)25(27(36)31-29(3,4)5)19-10-11-21-23(15-19)38-33-32-21/h6-11,15-16,20,22,24-25H,12-14H2,1-5H3,(H,30,35)(H,31,36)/t22-,24-,25-/m1/s1