N-[3-[4-(3-methylbutanoyl)piperazin-1-yl]-3-oxidanylidene-propyl]thiophene-3-carboxamide

Systemtic Name: N-[3-[4-(3-methylbutanoyl)piperazin-1-yl]-3-oxidanylidene-propyl]thiophene-3-carboxamide Openeye Name: N-[3-[4-(3-methylbutanoyl)piperazin-1-yl]-3-oxo-propyl]thiophene-3-carboxamide CAS Name: N-[3-[4-(3-methyl-1-oxobutyl)-1-piperazinyl]-3-oxopropyl]-3-thiophenecarboxamide IUPAC Name: N-[3-[4-(3-methylbutanoyl)piperazin-1-yl]-3-oxopropyl]thiophene-3-carboxamide Traditional Name: N-[3-(4-isovalerylpiperazino)-3-keto-propyl]thiophene-3-carboxamide Formula: C17H25N3O3S MolecularWeight: 351.4637

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCN(CC1)C(=O)CCNC(=O)C2=CSC=C2

Isomeric SMILES

CC(C)CC(=O)N1CCN(CC1)C(=O)CCNC(=O)C2=CSC=C2

InChI

InChI=1S/C17H25N3O3S/c1-13(2)11-16(22)20-8-6-19(7-9-20)15(21)3-5-18-17(23)14-4-10-24-12-14/h4,10,12-13H,3,5-9,11H2,1-2H3,(H,18,23)