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

Systemtic Name: 2-(5-bromanyl-2-methoxy-phenyl)-4-[(5-cyclopropyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole Openeye Name: 4-[(4-allyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-(5-bromo-2-methoxy-phenyl)thiazole CAS Name: 2-(5-bromo-2-methoxyphenyl)-4-[[(5-cyclopropyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]methyl]thiazole IUPAC Name: 2-(5-bromo-2-methoxyphenyl)-4-[(5-cyclopropyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole Traditional Name: 4-[[(4-allyl-5-cyclopropyl-1,2,4-triazol-3-yl)thio]methyl]-2-(5-bromo-2-methoxy-phenyl)thiazole Formula: C19H19BrN4OS2 MolecularWeight: 463.41436

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C2=NC(=CS2)CSC3=NN=C(N3CC=C)C4CC4

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C2=NC(=CS2)CSC3=NN=C(N3CC=C)C4CC4

InChI

InChI=1S/C19H19BrN4OS2/c1-3-8-24-17(12-4-5-12)22-23-19(24)27-11-14-10-26-18(21-14)15-9-13(20)6-7-16(15)25-2/h3,6-7,9-10,12H,1,4-5,8,11H2,2H3