4-[2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1-propyl-benzimidazol-5-yl]sulfonylmorpholine

Systemtic Name: 4-[2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1-propyl-benzimidazol-5-yl]sulfonylmorpholine Openeye Name: 4-[2-[(4-allyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1-propyl-benzimidazol-5-yl]sulfonylmorpholine CAS Name: 4-[[2-[[(4-prop-2-enyl-1,2,4-triazol-3-yl)thio]methyl]-1-propyl-5-benzimidazolyl]sulfonyl]morpholine IUPAC Name: 4-[2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1-propylbenzimidazol-5-yl]sulfonylmorpholine Traditional Name: 4-[2-[[(4-allyl-1,2,4-triazol-3-yl)thio]methyl]-1-propyl-benzimidazol-5-yl]sulfonylmorpholine Formula: C20H26N6O3S2 MolecularWeight: 462.58884

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CSC4=NN=CN4CC=C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CSC4=NN=CN4CC=C

InChI

InChI=1S/C20H26N6O3S2/c1-3-7-24-15-21-23-20(24)30-14-19-22-17-13-16(5-6-18(17)26(19)8-4-2)31(27,28)25-9-11-29-12-10-25/h3,5-6,13,15H,1,4,7-12,14H2,2H3