N-(2-methoxyphenyl)-4-[2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanoylamino]benzamide

Systemtic Name: N-(2-methoxyphenyl)-4-[2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanoylamino]benzamide Openeye Name: 4-[2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoylamino]-N-(2-methoxyphenyl)benzamide CAS Name: N-(2-methoxyphenyl)-4-[[2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]-1-oxopropyl]amino]benzamide IUPAC Name: N-(2-methoxyphenyl)-4-[2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanoylamino]benzamide Traditional Name: 4-[2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]propanoylamino]-N-(2-methoxyphenyl)benzamide Formula: C23H25N5O3S MolecularWeight: 451.5413

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC=C)SC(C)C(=O)NC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3OC

Isomeric SMILES

CC1=NN=C(N1CC=C)SC(C)C(=O)NC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3OC

InChI

InChI=1S/C23H25N5O3S/c1-5-14-28-16(3)26-27-23(28)32-15(2)21(29)24-18-12-10-17(11-13-18)22(30)25-19-8-6-7-9-20(19)31-4/h5-13,15H,1,14H2,2-4H3,(H,24,29)(H,25,30)