4-tert-butyl-N-[3-oxidanylidene-3-[(5-pentyl-1,3,4-thiadiazol-2-yl)amino]propyl]benzamide

Systemtic Name: 4-tert-butyl-N-[3-oxidanylidene-3-[(5-pentyl-1,3,4-thiadiazol-2-yl)amino]propyl]benzamide Openeye Name: 4-tert-butyl-N-[3-oxo-3-[(5-pentyl-1,3,4-thiadiazol-2-yl)amino]propyl]benzamide CAS Name: 4-tert-butyl-N-[3-oxo-3-[(5-pentyl-1,3,4-thiadiazol-2-yl)amino]propyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-oxo-3-[(5-pentyl-1,3,4-thiadiazol-2-yl)amino]propyl]benzamide Traditional Name: N-[3-[(5-amyl-1,3,4-thiadiazol-2-yl)amino]-3-keto-propyl]-4-tert-butyl-benzamide Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)NC(=O)CCNC(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCCCCC1=NN=C(S1)NC(=O)CCNC(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C21H30N4O2S/c1-5-6-7-8-18-24-25-20(28-18)23-17(26)13-14-22-19(27)15-9-11-16(12-10-15)21(2,3)4/h9-12H,5-8,13-14H2,1-4H3,(H,22,27)(H,23,25,26)