N-[4-[4-(3-acetamidopropyl)phenyl]-1,3-thiazol-2-yl]-1-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[4-[4-(3-acetamidopropyl)phenyl]-1,3-thiazol-2-yl]-1-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-[4-[4-(3-acetamidopropyl)phenyl]thiazol-2-yl]-1-phenyl-triazole-4-carboxamide CAS Name: N-[4-[4-(3-acetamidopropyl)phenyl]-2-thiazolyl]-1-phenyl-4-triazolecarboxamide IUPAC Name: N-[4-[4-(3-acetamidopropyl)phenyl]-1,3-thiazol-2-yl]-1-phenyltriazole-4-carboxamide Traditional Name: N-[4-[4-(3-acetamidopropyl)phenyl]thiazol-2-yl]-1-phenyl-triazole-4-carboxamide Formula: C23H22N6O2S MolecularWeight: 446.52478

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CN(N=N3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NCCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CN(N=N3)C4=CC=CC=C4

InChI

InChI=1S/C23H22N6O2S/c1-16(30)24-13-5-6-17-9-11-18(12-10-17)21-15-32-23(25-21)26-22(31)20-14-29(28-27-20)19-7-3-2-4-8-19/h2-4,7-12,14-15H,5-6,13H2,1H3,(H,24,30)(H,25,26,31)