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

Systemtic Name: N-cyclopentyl-2-[2-[(4-methyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzamide Openeye Name: N-cyclopentyl-2-[[2-[(4-methyl-5-morpholino-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzamide CAS Name: N-cyclopentyl-2-[[2-[[4-methyl-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-cyclopentyl-2-[[2-[(4-methyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzamide Traditional Name: N-cyclopentyl-2-[[2-[(4-methyl-5-morpholino-1,2,4-triazol-3-yl)thio]acetyl]amino]benzamide Formula: C21H28N6O3S MolecularWeight: 444.55042

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)NC2=CC=CC=C2C(=O)NC3CCCC3)N4CCOCC4

Isomeric SMILES

CN1C(=NN=C1SCC(=O)NC2=CC=CC=C2C(=O)NC3CCCC3)N4CCOCC4

InChI

InChI=1S/C21H28N6O3S/c1-26-20(27-10-12-30-13-11-27)24-25-21(26)31-14-18(28)23-17-9-5-4-8-16(17)19(29)22-15-6-2-3-7-15/h4-5,8-9,15H,2-3,6-7,10-14H2,1H3,(H,22,29)(H,23,28)