N-(4-azanylcyclohexyl)-N-[[3-[3-azanyl-4-(4-methylpiperazin-1-yl)phenyl]phenyl]methyl]thiophene-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-N-[[3-[3-azanyl-4-(4-methylpiperazin-1-yl)phenyl]phenyl]methyl]thiophene-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-N-[[3-[3-amino-4-(4-methylpiperazin-1-yl)phenyl]phenyl]methyl]thiophene-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-N-[[3-[3-amino-4-(4-methyl-1-piperazinyl)phenyl]phenyl]methyl]-2-thiophenecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-N-[[3-[3-amino-4-(4-methylpiperazin-1-yl)phenyl]phenyl]methyl]thiophene-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-N-[3-[3-amino-4-(4-methylpiperazino)phenyl]benzyl]thiophene-2-carboxamide Formula: C29H37N5OS MolecularWeight: 503.70198

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)C3=CC(=CC=C3)CN(C4CCC(CC4)N)C(=O)C5=CC=CS5)N

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)C3=CC(=CC=C3)CN(C4CCC(CC4)N)C(=O)C5=CC=CS5)N

InChI

InChI=1S/C29H37N5OS/c1-32-13-15-33(16-14-32)27-12-7-23(19-26(27)31)22-5-2-4-21(18-22)20-34(25-10-8-24(30)9-11-25)29(35)28-6-3-17-36-28/h2-7,12,17-19,24-25H,8-11,13-16,20,30-31H2,1H3