4-[2-[[4-ethyl-5-(3-methoxy-1-methyl-pyrazol-4-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzamide

Systemtic Name: 4-[2-[[4-ethyl-5-(3-methoxy-1-methyl-pyrazol-4-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzamide Openeye Name: 4-[[2-[[4-ethyl-5-(3-methoxy-1-methyl-pyrazol-4-yl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide CAS Name: 4-[[2-[[4-ethyl-5-(3-methoxy-1-methyl-4-pyrazolyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[[4-ethyl-5-(3-methoxy-1-methylpyrazol-4-yl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide Traditional Name: 4-[[2-[[4-ethyl-5-(3-methoxy-1-methyl-pyrazol-4-yl)-1,2,4-triazol-3-yl]thio]acetyl]amino]benzamide Formula: C18H21N7O3S MolecularWeight: 415.46944

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)N)C3=CN(N=C3OC)C

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)N)C3=CN(N=C3OC)C

InChI

InChI=1S/C18H21N7O3S/c1-4-25-16(13-9-24(2)23-17(13)28-3)21-22-18(25)29-10-14(26)20-12-7-5-11(6-8-12)15(19)27/h5-9H,4,10H2,1-3H3,(H2,19,27)(H,20,26)