N-[2-chloranyl-5-[4-[2-(diethylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]carbonyl-phenyl]thiophene-2-carboxamide

Systemtic Name: N-[2-chloranyl-5-[4-[2-(diethylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]carbonyl-phenyl]thiophene-2-carboxamide Openeye Name: N-[2-chloro-5-[4-[2-(diethylamino)-2-oxo-ethyl]piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide CAS Name: N-[2-chloro-5-[[4-[2-(diethylamino)-2-oxoethyl]-1-piperazinyl]-oxomethyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[2-chloro-5-[4-[2-(diethylamino)-2-oxoethyl]piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[2-chloro-5-[4-[2-(diethylamino)-2-keto-ethyl]piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide Formula: C22H27ClN4O3S MolecularWeight: 462.99278

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CN1CCN(CC1)C(=O)C2=CC(=C(C=C2)Cl)NC(=O)C3=CC=CS3

Isomeric SMILES

CCN(CC)C(=O)CN1CCN(CC1)C(=O)C2=CC(=C(C=C2)Cl)NC(=O)C3=CC=CS3

InChI

InChI=1S/C22H27ClN4O3S/c1-3-26(4-2)20(28)15-25-9-11-27(12-10-25)22(30)16-7-8-17(23)18(14-16)24-21(29)19-6-5-13-31-19/h5-8,13-14H,3-4,9-12,15H2,1-2H3,(H,24,29)