4-methyl-N-[(4-pentoxyphenyl)carbamothioyl]-1,2,3-thiadiazole-5-carboxamide

Systemtic Name: 4-methyl-N-[(4-pentoxyphenyl)carbamothioyl]-1,2,3-thiadiazole-5-carboxamide Openeye Name: 4-methyl-N-[(4-pentoxyphenyl)carbamothioyl]thiadiazole-5-carboxamide CAS Name: 4-methyl-N-[(4-pentoxyanilino)-sulfanylidenemethyl]-5-thiadiazolecarboxamide IUPAC Name: 4-methyl-N-[(4-pentoxyphenyl)carbamothioyl]thiadiazole-5-carboxamide Traditional Name: N-[(4-amoxyphenyl)thiocarbamoyl]-4-methyl-thiadiazole-5-carboxamide Formula: C16H20N4O2S2 MolecularWeight: 364.4856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(N=NS2)C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(N=NS2)C

InChI

InChI=1S/C16H20N4O2S2/c1-3-4-5-10-22-13-8-6-12(7-9-13)17-16(23)18-15(21)14-11(2)19-20-24-14/h6-9H,3-5,10H2,1-2H3,(H2,17,18,21,23)