N-[3-chloranyl-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[3-chloranyl-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]thiophene-2-carboxamide Openeye Name: N-[3-chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]thiophene-2-carboxamide CAS Name: N-[3-chloro-4-[4-(3-methyl-1-oxobutyl)-1-piperazinyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[3-chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]thiophene-2-carboxamide Traditional Name: N-[3-chloro-4-(4-isovalerylpiperazino)phenyl]thiophene-2-carboxamide Formula: C20H24ClN3O2S MolecularWeight: 405.94146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24ClN3O2S/c1-14(2)12-19(25)24-9-7-23(8-10-24)17-6-5-15(13-16(17)21)22-20(26)18-4-3-11-27-18/h3-6,11,13-14H,7-10,12H2,1-2H3,(H,22,26)