2-[(4-bromophenyl)amino]-4-methyl-N-[(1S,2S)-2-phenylmethoxycyclopentyl]-1,3-thiazole-5-carboxamide

Systemtic Name: 2-[(4-bromophenyl)amino]-4-methyl-N-[(1S,2S)-2-phenylmethoxycyclopentyl]-1,3-thiazole-5-carboxamide Openeye Name: N-[(1S,2S)-2-benzyloxycyclopentyl]-2-(4-bromoanilino)-4-methyl-thiazole-5-carboxamide CAS Name: 2-(4-bromoanilino)-4-methyl-N-[(1S,2S)-2-phenylmethoxycyclopentyl]-5-thiazolecarboxamide IUPAC Name: 2-(4-bromoanilino)-4-methyl-N-[(1S,2S)-2-phenylmethoxycyclopentyl]-1,3-thiazole-5-carboxamide Traditional Name: N-[(1S,2S)-2-benzoxycyclopentyl]-2-(4-bromoanilino)-4-methyl-thiazole-5-carboxamide Formula: C23H24BrN3O2S MolecularWeight: 486.42456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC2=CC=C(C=C2)Br)C(=O)NC3CCCC3OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC(=N1)NC2=CC=C(C=C2)Br)C(=O)N[C@H]3CCC[C@@H]3OCC4=CC=CC=C4

InChI

InChI=1S/C23H24BrN3O2S/c1-15-21(30-23(25-15)26-18-12-10-17(24)11-13-18)22(28)27-19-8-5-9-20(19)29-14-16-6-3-2-4-7-16/h2-4,6-7,10-13,19-20H,5,8-9,14H2,1H3,(H,25,26)(H,27,28)/t19-,20-/m0/s1