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

Systemtic Name: 2-(4-ethoxyphenyl)-4-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole Openeye Name: 4-[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-2-(4-ethoxyphenyl)thiazole CAS Name: 2-(4-ethoxyphenyl)-4-[[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]methyl]thiazole IUPAC Name: 2-(4-ethoxyphenyl)-4-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole Traditional Name: 4-[[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]-2-p-phenetyl-thiazole Formula: C22H21N5OS2 MolecularWeight: 435.56504

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC(=CS2)CSC3=NN=C(N3CC=C)C4=CC=NC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC(=CS2)CSC3=NN=C(N3CC=C)C4=CC=NC=C4

InChI

InChI=1S/C22H21N5OS2/c1-3-13-27-20(16-9-11-23-12-10-16)25-26-22(27)30-15-18-14-29-21(24-18)17-5-7-19(8-6-17)28-4-2/h3,5-12,14H,1,4,13,15H2,2H3