N-[(2,4-dimethylphenyl)carbamoyl]-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-[(2,4-dimethylanilino)-oxomethyl]-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C21H24N6O2S MolecularWeight: 424.51926

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C)C(=O)NC(=O)NC2=C(C=C(C=C2)C)C)C3=CC=NC=C3

Isomeric SMILES

CCN1C(=NN=C1SC(C)C(=O)NC(=O)NC2=C(C=C(C=C2)C)C)C3=CC=NC=C3

InChI

InChI=1S/C21H24N6O2S/c1-5-27-18(16-8-10-22-11-9-16)25-26-21(27)30-15(4)19(28)24-20(29)23-17-7-6-13(2)12-14(17)3/h6-12,15H,5H2,1-4H3,(H2,23,24,28,29)