2-phenyl-4-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole

Systemtic Name: 2-phenyl-4-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole Openeye Name: 4-[[4-allyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-2-phenyl-thiazole CAS Name: 2-phenyl-4-[[[4-prop-2-enyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]methyl]thiazole IUPAC Name: 2-phenyl-4-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole Traditional Name: 4-[[[4-allyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]-2-phenyl-thiazole Formula: C20H17N5S2 MolecularWeight: 391.51248

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC2=CSC(=N2)C3=CC=CC=C3)C4=CN=CC=C4

Isomeric SMILES

C=CCN1C(=NN=C1SCC2=CSC(=N2)C3=CC=CC=C3)C4=CN=CC=C4

InChI

InChI=1S/C20H17N5S2/c1-2-11-25-18(16-9-6-10-21-12-16)23-24-20(25)27-14-17-13-26-19(22-17)15-7-4-3-5-8-15/h2-10,12-13H,1,11,14H2