N-[4-[[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]carbamoyl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]carbamoyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]carbamoyl]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[[2-methyl-4-(4-methyl-1-piperazin-4-iumyl)anilino]-oxomethyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]carbamoyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]carbamoyl]phenyl]thiophene-2-carboxamide Formula: C24H27N4O2S+ MolecularWeight: 435.56178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C24H26N4O2S/c1-17-16-20(28-13-11-27(2)12-14-28)9-10-21(17)26-23(29)18-5-7-19(8-6-18)25-24(30)22-4-3-15-31-22/h3-10,15-16H,11-14H2,1-2H3,(H,25,30)(H,26,29)/p+1