N-[1-[5-(2-chloranylprop-2-enylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]-2-phenyl-ethyl]-3-methyl-thiophene-2-carboxamide

Systemtic Name: N-[1-[5-(2-chloranylprop-2-enylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]-2-phenyl-ethyl]-3-methyl-thiophene-2-carboxamide Openeye Name: N-[1-[5-(2-chloroallylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]-2-phenyl-ethyl]-3-methyl-thiophene-2-carboxamide CAS Name: N-[1-[5-(2-chloroprop-2-enylthio)-4-methyl-1,2,4-triazol-3-yl]-2-phenylethyl]-3-methyl-2-thiophenecarboxamide IUPAC Name: N-[1-[5-(2-chloroprop-2-enylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]-2-phenylethyl]-3-methylthiophene-2-carboxamide Traditional Name: N-[1-[5-(2-chloroallylthio)-4-methyl-1,2,4-triazol-3-yl]-2-phenyl-ethyl]-3-methyl-thiophene-2-carboxamide Formula: C20H21ClN4OS2 MolecularWeight: 432.98994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)NC(CC2=CC=CC=C2)C3=NN=C(N3C)SCC(=C)Cl

Isomeric SMILES

CC1=C(SC=C1)C(=O)NC(CC2=CC=CC=C2)C3=NN=C(N3C)SCC(=C)Cl

InChI

InChI=1S/C20H21ClN4OS2/c1-13-9-10-27-17(13)19(26)22-16(11-15-7-5-4-6-8-15)18-23-24-20(25(18)3)28-12-14(2)21/h4-10,16H,2,11-12H2,1,3H3,(H,22,26)