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

Systemtic Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[[4-propyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-[(2,4-dimethylanilino)-oxomethyl]-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[[4-propyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C22H26N6O2S MolecularWeight: 438.54584

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SC(C)C(=O)NC(=O)NC2=C(C=C(C=C2)C)C)C3=CC=NC=C3

Isomeric SMILES

CCCN1C(=NN=C1SC(C)C(=O)NC(=O)NC2=C(C=C(C=C2)C)C)C3=CC=NC=C3

InChI

InChI=1S/C22H26N6O2S/c1-5-12-28-19(17-8-10-23-11-9-17)26-27-22(28)31-16(4)20(29)25-21(30)24-18-7-6-14(2)13-15(18)3/h6-11,13,16H,5,12H2,1-4H3,(H2,24,25,29,30)