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

Systemtic Name: N-[2-chloranyl-5-[4-(2-methylpropanoyl)piperazin-1-yl]carbonyl-phenyl]thiophene-2-carboxamide Openeye Name: N-[2-chloro-5-[4-(2-methylpropanoyl)piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide CAS Name: N-[2-chloro-5-[[4-(2-methyl-1-oxopropyl)-1-piperazinyl]-oxomethyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[2-chloro-5-[4-(2-methylpropanoyl)piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[2-chloro-5-(4-isobutyrylpiperazine-1-carbonyl)phenyl]thiophene-2-carboxamide Formula: C20H22ClN3O3S MolecularWeight: 419.92498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C(=O)C2=CC(=C(C=C2)Cl)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C(=O)C2=CC(=C(C=C2)Cl)NC(=O)C3=CC=CS3

InChI

InChI=1S/C20H22ClN3O3S/c1-13(2)19(26)23-7-9-24(10-8-23)20(27)14-5-6-15(21)16(12-14)22-18(25)17-4-3-11-28-17/h3-6,11-13H,7-10H2,1-2H3,(H,22,25)