2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-methyl-N-[(1S,2S)-2-phenylmethoxycyclopentyl]-1,3-thiazole-5-carboxamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-methyl-N-[(1S,2S)-2-phenylmethoxycyclopentyl]-1,3-thiazole-5-carboxamide Openeye Name: N-[(1S,2S)-2-benzyloxycyclopentyl]-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-methyl-thiazole-5-carboxamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-methyl-N-[(1S,2S)-2-phenylmethoxycyclopentyl]-5-thiazolecarboxamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-methyl-N-[(1S,2S)-2-phenylmethoxycyclopentyl]-1,3-thiazole-5-carboxamide Traditional Name: N-[(1S,2S)-2-benzoxycyclopentyl]-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-methyl-thiazole-5-carboxamide Formula: C25H27N3O4S MolecularWeight: 465.56458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC2=CC3=C(C=C2)OCCO3)C(=O)NC4CCCC4OCC5=CC=CC=C5

Isomeric SMILES

CC1=C(SC(=N1)NC2=CC3=C(C=C2)OCCO3)C(=O)N[C@H]4CCC[C@@H]4OCC5=CC=CC=C5

InChI

InChI=1S/C25H27N3O4S/c1-16-23(33-25(26-16)27-18-10-11-21-22(14-18)31-13-12-30-21)24(29)28-19-8-5-9-20(19)32-15-17-6-3-2-4-7-17/h2-4,6-7,10-11,14,19-20H,5,8-9,12-13,15H2,1H3,(H,26,27)(H,28,29)/t19-,20-/m0/s1