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

Systemtic Name: N-[4-[4-(acetamidomethyl)phenyl]-1,3-thiazol-2-yl]-2-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-[4-[4-(acetamidomethyl)phenyl]thiazol-2-yl]-2-phenyl-triazole-4-carboxamide CAS Name: N-[4-[4-(acetamidomethyl)phenyl]-2-thiazolyl]-2-phenyl-4-triazolecarboxamide IUPAC Name: N-[4-[4-(acetamidomethyl)phenyl]-1,3-thiazol-2-yl]-2-phenyltriazole-4-carboxamide Traditional Name: N-[4-[4-(acetamidomethyl)phenyl]thiazol-2-yl]-2-phenyl-triazole-4-carboxamide Formula: C21H18N6O2S MolecularWeight: 418.47162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=NN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=NN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H18N6O2S/c1-14(28)22-11-15-7-9-16(10-8-15)19-13-30-21(24-19)25-20(29)18-12-23-27(26-18)17-5-3-2-4-6-17/h2-10,12-13H,11H2,1H3,(H,22,28)(H,24,25,29)