4-ethanoyl-3,5-dimethyl-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide

Systemtic Name: 4-ethanoyl-3,5-dimethyl-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide Openeye Name: 4-acetyl-N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3,5-dimethyl-1H-pyrrole-2-carboxamide CAS Name: 4-acetyl-3,5-dimethyl-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-acetyl-N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3,5-dimethyl-1H-pyrrole-2-carboxamide Traditional Name: 4-acetyl-N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-3,5-dimethyl-1H-pyrrole-2-carboxamide Formula: C18H18N4O2S2 MolecularWeight: 386.49112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)NC2=NN=C(S2)SCC3=CC=CC=C3

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)NC2=NN=C(S2)SCC3=CC=CC=C3

InChI

InChI=1S/C18H18N4O2S2/c1-10-14(12(3)23)11(2)19-15(10)16(24)20-17-21-22-18(26-17)25-9-13-7-5-4-6-8-13/h4-8,19H,9H2,1-3H3,(H,20,21,24)