ethyl 2-[2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanoylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanoylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[2-[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]propanoylamino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-1-oxopropyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanoylamino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[2-[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]propanoylamino]-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C24H23N5O3S2 MolecularWeight: 493.60112

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C(C)SC3=NN=C(N3C)C4=CC=NC=C4

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C(C)SC3=NN=C(N3C)C4=CC=NC=C4

InChI

InChI=1S/C24H23N5O3S2/c1-4-32-23(31)18-14-19(16-8-6-5-7-9-16)34-22(18)26-21(30)15(2)33-24-28-27-20(29(24)3)17-10-12-25-13-11-17/h5-15H,4H2,1-3H3,(H,26,30)