N-butyl-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-butyl-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole-4-carboxamide Openeye Name: N-butyl-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]thiazole-4-carboxamide CAS Name: N-butyl-2-[[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-4-thiazolecarboxamide IUPAC Name: N-butyl-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole-4-carboxamide Traditional Name: N-butyl-2-[[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]thiazole-4-carboxamide Formula: C18H21N5OS2 MolecularWeight: 387.52224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CSC(=N1)CSC2=NN=C(N2C3=CC=CC=C3)C

Isomeric SMILES

CCCCNC(=O)C1=CSC(=N1)CSC2=NN=C(N2C3=CC=CC=C3)C

InChI

InChI=1S/C18H21N5OS2/c1-3-4-10-19-17(24)15-11-25-16(20-15)12-26-18-22-21-13(2)23(18)14-8-6-5-7-9-14/h5-9,11H,3-4,10,12H2,1-2H3,(H,19,24)