ethyl 2-[2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl-phenyl-amino]ethanoate

Systemtic Name: ethyl 2-[2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl-phenyl-amino]ethanoate Openeye Name: ethyl 2-(N-[2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]anilino)acetate CAS Name: 2-(N-[2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]anilino)acetic acid ethyl ester IUPAC Name: ethyl 2-(N-[2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]anilino)acetate Traditional Name: 2-(N-[2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]acetyl]anilino)acetic acid ethyl ester Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C1=CC=CC=C1)C(=O)CSC2=NN=C(N2C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)CN(C1=CC=CC=C1)C(=O)CSC2=NN=C(N2C3=CC=CC=C3)C

InChI

InChI=1S/C21H22N4O3S/c1-3-28-20(27)14-24(17-10-6-4-7-11-17)19(26)15-29-21-23-22-16(2)25(21)18-12-8-5-9-13-18/h4-13H,3,14-15H2,1-2H3