N-[5-[4-[2-(butylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]carbonyl-4-methyl-thiophen-2-yl]furan-2-carboxamide

Systemtic Name: N-[5-[4-[2-(butylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]carbonyl-4-methyl-thiophen-2-yl]furan-2-carboxamide Openeye Name: N-[5-[4-[2-(butylamino)-2-oxo-ethyl]piperazine-1-carbonyl]-4-methyl-2-thienyl]furan-2-carboxamide CAS Name: N-[5-[[4-[2-(butylamino)-2-oxoethyl]-1-piperazinyl]-oxomethyl]-4-methyl-2-thiophenyl]-2-furancarboxamide IUPAC Name: N-[5-[4-[2-(butylamino)-2-oxoethyl]piperazine-1-carbonyl]-4-methylthiophen-2-yl]furan-2-carboxamide Traditional Name: N-[5-[4-[2-(butylamino)-2-keto-ethyl]piperazine-1-carbonyl]-4-methyl-2-thienyl]-2-furamide Formula: C21H28N4O4S MolecularWeight: 432.53642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1CCN(CC1)C(=O)C2=C(C=C(S2)NC(=O)C3=CC=CO3)C

Isomeric SMILES

CCCCNC(=O)CN1CCN(CC1)C(=O)C2=C(C=C(S2)NC(=O)C3=CC=CO3)C

InChI

InChI=1S/C21H28N4O4S/c1-3-4-7-22-17(26)14-24-8-10-25(11-9-24)21(28)19-15(2)13-18(30-19)23-20(27)16-6-5-12-29-16/h5-6,12-13H,3-4,7-11,14H2,1-2H3,(H,22,26)(H,23,27)