N-[4-[2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]phenyl]butanamide

Systemtic Name: N-[4-[2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]phenyl]butanamide Openeye Name: N-[4-[[2-[[4-methyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]phenyl]butanamide CAS Name: N-[4-[[2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]phenyl]butanamide IUPAC Name: N-[4-[[2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]phenyl]butanamide Traditional Name: N-[4-[[2-[[4-methyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]phenyl]butyramide Formula: C19H21N5O2S2 MolecularWeight: 415.53234

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C)C3=CC=CS3

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C)C3=CC=CS3

InChI

InChI=1S/C19H21N5O2S2/c1-3-5-16(25)20-13-7-9-14(10-8-13)21-17(26)12-28-19-23-22-18(24(19)2)15-6-4-11-27-15/h4,6-11H,3,5,12H2,1-2H3,(H,20,25)(H,21,26)