4-ethyl-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-5-propyl-thiophene-2-carboxamide

Systemtic Name: 4-ethyl-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-5-propyl-thiophene-2-carboxamide Openeye Name: 4-ethyl-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-5-propyl-thiophene-2-carboxamide CAS Name: 4-ethyl-N-[2-methyl-4-(4-methyl-1-piperazinyl)phenyl]-5-propyl-2-thiophenecarboxamide IUPAC Name: 4-ethyl-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-5-propylthiophene-2-carboxamide Traditional Name: 4-ethyl-N-[2-methyl-4-(4-methylpiperazino)phenyl]-5-propyl-thiophene-2-carboxamide Formula: C22H31N3OS MolecularWeight: 385.56604

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(S1)C(=O)NC2=C(C=C(C=C2)N3CCN(CC3)C)C)CC

Isomeric SMILES

CCCC1=C(C=C(S1)C(=O)NC2=C(C=C(C=C2)N3CCN(CC3)C)C)CC

InChI

InChI=1S/C22H31N3OS/c1-5-7-20-17(6-2)15-21(27-20)22(26)23-19-9-8-18(14-16(19)3)25-12-10-24(4)11-13-25/h8-9,14-15H,5-7,10-13H2,1-4H3,(H,23,26)