N-[[2-(phenylmethyl)-1,3-thiazol-4-yl]methyl]-2-propan-2-yl-1,3-benzoxazole-5-carboxamide

Systemtic Name: N-[[2-(phenylmethyl)-1,3-thiazol-4-yl]methyl]-2-propan-2-yl-1,3-benzoxazole-5-carboxamide Openeye Name: N-[(2-benzylthiazol-4-yl)methyl]-2-isopropyl-1,3-benzoxazole-5-carboxamide CAS Name: N-[[2-(phenylmethyl)-4-thiazolyl]methyl]-2-propan-2-yl-1,3-benzoxazole-5-carboxamide IUPAC Name: N-[(2-benzyl-1,3-thiazol-4-yl)methyl]-2-propan-2-yl-1,3-benzoxazole-5-carboxamide Traditional Name: N-[(2-benzylthiazol-4-yl)methyl]-2-isopropyl-1,3-benzoxazole-5-carboxamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(O1)C=CC(=C2)C(=O)NCC3=CSC(=N3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=NC2=C(O1)C=CC(=C2)C(=O)NCC3=CSC(=N3)CC4=CC=CC=C4

InChI

InChI=1S/C22H21N3O2S/c1-14(2)22-25-18-11-16(8-9-19(18)27-22)21(26)23-12-17-13-28-20(24-17)10-15-6-4-3-5-7-15/h3-9,11,13-14H,10,12H2,1-2H3,(H,23,26)