1-[4-methyl-5-(3-phenylprop-2-enylsulfonyl)-1,2,4-triazol-3-yl]butan-1-amine

Systemtic Name: 1-[4-methyl-5-(3-phenylprop-2-enylsulfonyl)-1,2,4-triazol-3-yl]butan-1-amine Openeye Name: 1-(5-cinnamylsulfonyl-4-methyl-1,2,4-triazol-3-yl)butan-1-amine CAS Name: 1-[4-methyl-5-(3-phenylprop-2-enylsulfonyl)-1,2,4-triazol-3-yl]-1-butanamine IUPAC Name: 1-[4-methyl-5-(3-phenylprop-2-enylsulfonyl)-1,2,4-triazol-3-yl]butan-1-amine Traditional Name: 1-(5-cinnamylsulfonyl-4-methyl-1,2,4-triazol-3-yl)butylamine Formula: C16H22N4O2S MolecularWeight: 334.43648

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=NN=C(N1C)S(=O)(=O)CC=CC2=CC=CC=C2)N

Isomeric SMILES

CCCC(C1=NN=C(N1C)S(=O)(=O)CC=CC2=CC=CC=C2)N

InChI

InChI=1S/C16H22N4O2S/c1-3-8-14(17)15-18-19-16(20(15)2)23(21,22)12-7-11-13-9-5-4-6-10-13/h4-7,9-11,14H,3,8,12,17H2,1-2H3