N-(4-butan-2-ylphenyl)-4-[(2-methylpropanoylamino)methyl]-1,2,3-thiadiazole-5-carboxamide

Systemtic Name: N-(4-butan-2-ylphenyl)-4-[(2-methylpropanoylamino)methyl]-1,2,3-thiadiazole-5-carboxamide Openeye Name: 4-[(2-methylpropanoylamino)methyl]-N-(4-sec-butylphenyl)thiadiazole-5-carboxamide CAS Name: N-(4-butan-2-ylphenyl)-4-[[(2-methyl-1-oxopropyl)amino]methyl]-5-thiadiazolecarboxamide IUPAC Name: N-(4-butan-2-ylphenyl)-4-[(2-methylpropanoylamino)methyl]thiadiazole-5-carboxamide Traditional Name: 4-[(isobutyrylamino)methyl]-N-(4-sec-butylphenyl)thiadiazole-5-carboxamide Formula: C18H24N4O2S MolecularWeight: 360.47376

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)C2=C(N=NS2)CNC(=O)C(C)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=O)C2=C(N=NS2)CNC(=O)C(C)C

InChI

InChI=1S/C18H24N4O2S/c1-5-12(4)13-6-8-14(9-7-13)20-18(24)16-15(21-22-25-16)10-19-17(23)11(2)3/h6-9,11-12H,5,10H2,1-4H3,(H,19,23)(H,20,24)