[[4-(diethylamino)-2-methyl-phenyl]-ethanoyl-amino] (1Z)-N-oxidanylpyrrolidine-1-carboximidothioate

Systemtic Name: [[4-(diethylamino)-2-methyl-phenyl]-ethanoyl-amino] (1Z)-N-oxidanylpyrrolidine-1-carboximidothioate Openeye Name: [N-acetyl-4-(diethylamino)-2-methyl-anilino] (1Z)-N-hydroxypyrrolidine-1-carboximidothioate CAS Name: (1Z)-N-hydroxy-1-pyrrolidinecarboximidothioic acid [N-acetyl-4-(diethylamino)-2-methylanilino] ester IUPAC Name: [N-acetyl-4-(diethylamino)-2-methylanilino] (1Z)-N-hydroxypyrrolidine-1-carboximidothioate Traditional Name: (1Z)-N-hydroxypyrrolidine-1-carboximidothioic acid [N-acetyl-4-(diethylamino)-2-methyl-anilino] ester Formula: C18H28N4O2S MolecularWeight: 364.50552

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)N(C(=O)C)SC(=NO)N2CCCC2)C

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)N(C(=O)C)S/C(=N\O)/N2CCCC2)C

InChI

InChI=1S/C18H28N4O2S/c1-5-20(6-2)16-9-10-17(14(3)13-16)22(15(4)23)25-18(19-24)21-11-7-8-12-21/h9-10,13,24H,5-8,11-12H2,1-4H3/b19-18-