N-[4-[[4-(4-iodophenyl)-1,3-thiazol-2-yl]amino]-4-oxidanylidene-butyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[[4-(4-iodophenyl)-1,3-thiazol-2-yl]amino]-4-oxidanylidene-butyl]thiophene-2-carboxamide Openeye Name: N-[4-[[4-(4-iodophenyl)thiazol-2-yl]amino]-4-oxo-butyl]thiophene-2-carboxamide CAS Name: N-[4-[[4-(4-iodophenyl)-2-thiazolyl]amino]-4-oxobutyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[[4-(4-iodophenyl)-1,3-thiazol-2-yl]amino]-4-oxobutyl]thiophene-2-carboxamide Traditional Name: N-[4-[[4-(4-iodophenyl)thiazol-2-yl]amino]-4-keto-butyl]thiophene-2-carboxamide Formula: C18H16IN3O2S2 MolecularWeight: 497.37301

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)NCCCC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)I

Isomeric SMILES

C1=CSC(=C1)C(=O)NCCCC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)I

InChI

InChI=1S/C18H16IN3O2S2/c19-13-7-5-12(6-8-13)14-11-26-18(21-14)22-16(23)4-1-9-20-17(24)15-3-2-10-25-15/h2-3,5-8,10-11H,1,4,9H2,(H,20,24)(H,21,22,23)