N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: 2-[[4-allyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4,5-dimethylthiazol-2-yl)propanamide CAS Name: N-(4,5-dimethyl-2-thiazolyl)-2-[[4-prop-2-enyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: 2-[[4-allyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-(4,5-dimethylthiazol-2-yl)propionamide Formula: C18H20N6OS2 MolecularWeight: 400.521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C(C)SC2=NN=C(N2CC=C)C3=CN=CC=C3)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C(C)SC2=NN=C(N2CC=C)C3=CN=CC=C3)C

InChI

InChI=1S/C18H20N6OS2/c1-5-9-24-15(14-7-6-8-19-10-14)22-23-18(24)27-13(4)16(25)21-17-20-11(2)12(3)26-17/h5-8,10,13H,1,9H2,2-4H3,(H,20,21,25)