4-[2-[(4-ethyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N,N-dimethyl-benzamide

Systemtic Name: 4-[2-[(4-ethyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N,N-dimethyl-benzamide Openeye Name: 4-[[2-[(4-ethyl-5-morpholino-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N,N-dimethyl-benzamide CAS Name: 4-[[2-[[4-ethyl-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]-N,N-dimethylbenzamide IUPAC Name: 4-[[2-[(4-ethyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N,N-dimethylbenzamide Traditional Name: 4-[[2-[(4-ethyl-5-morpholino-1,2,4-triazol-3-yl)thio]acetyl]amino]-N,N-dimethyl-benzamide Formula: C19H26N6O3S MolecularWeight: 418.51314

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)N(C)C)N3CCOCC3

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)N(C)C)N3CCOCC3

InChI

InChI=1S/C19H26N6O3S/c1-4-25-18(24-9-11-28-12-10-24)21-22-19(25)29-13-16(26)20-15-7-5-14(6-8-15)17(27)23(2)3/h5-8H,4,9-13H2,1-3H3,(H,20,26)