N-heptan-2-yl-4-(4-methoxyphenyl)-1,2,3-thiadiazole-5-carboxamide

Systemtic Name: N-heptan-2-yl-4-(4-methoxyphenyl)-1,2,3-thiadiazole-5-carboxamide Openeye Name: 4-(4-methoxyphenyl)-N-(1-methylhexyl)thiadiazole-5-carboxamide CAS Name: N-heptan-2-yl-4-(4-methoxyphenyl)-5-thiadiazolecarboxamide IUPAC Name: N-heptan-2-yl-4-(4-methoxyphenyl)thiadiazole-5-carboxamide Traditional Name: 4-(4-methoxyphenyl)-N-(1-methylhexyl)thiadiazole-5-carboxamide Formula: C17H23N3O2S MolecularWeight: 333.44842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)C1=C(N=NS1)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCCCC(C)NC(=O)C1=C(N=NS1)C2=CC=C(C=C2)OC

InChI

InChI=1S/C17H23N3O2S/c1-4-5-6-7-12(2)18-17(21)16-15(19-20-23-16)13-8-10-14(22-3)11-9-13/h8-12H,4-7H2,1-3H3,(H,18,21)