N-[5-methyl-3-[(4-methylpiperazin-1-yl)-(4-methylsulfanylphenyl)methyl]thiophen-2-yl]furan-2-carboxamide

Systemtic Name: N-[5-methyl-3-[(4-methylpiperazin-1-yl)-(4-methylsulfanylphenyl)methyl]thiophen-2-yl]furan-2-carboxamide Openeye Name: N-[5-methyl-3-[(4-methylpiperazin-1-yl)-(4-methylsulfanylphenyl)methyl]-2-thienyl]furan-2-carboxamide CAS Name: N-[5-methyl-3-[(4-methyl-1-piperazinyl)-[4-(methylthio)phenyl]methyl]-2-thiophenyl]-2-furancarboxamide IUPAC Name: N-[5-methyl-3-[(4-methylpiperazin-1-yl)-(4-methylsulfanylphenyl)methyl]thiophen-2-yl]furan-2-carboxamide Traditional Name: N-[5-methyl-3-[(4-methylpiperazino)-[4-(methylthio)phenyl]methyl]-2-thienyl]-2-furamide Formula: C23H27N3O2S2 MolecularWeight: 441.60938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C2=CC=CO2)C(C3=CC=C(C=C3)SC)N4CCN(CC4)C

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)C2=CC=CO2)C(C3=CC=C(C=C3)SC)N4CCN(CC4)C

InChI

InChI=1S/C23H27N3O2S2/c1-16-15-19(23(30-16)24-22(27)20-5-4-14-28-20)21(26-12-10-25(2)11-13-26)17-6-8-18(29-3)9-7-17/h4-9,14-15,21H,10-13H2,1-3H3,(H,24,27)