N-[3-methyl-1-[4-[4-(3-methylphenyl)piperazin-1-yl]butylamino]-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[3-methyl-1-[4-[4-(3-methylphenyl)piperazin-1-yl]butylamino]-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide Openeye Name: N-[2-methyl-1-[4-[4-(m-tolyl)piperazin-1-yl]butylcarbamoyl]propyl]thiophene-2-carboxamide CAS Name: N-[3-methyl-1-[4-[4-(3-methylphenyl)-1-piperazinyl]butylamino]-1-oxobutan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[3-methyl-1-[4-[4-(3-methylphenyl)piperazin-1-yl]butylamino]-1-oxobutan-2-yl]thiophene-2-carboxamide Traditional Name: N-[2-methyl-1-[4-[4-(m-tolyl)piperazino]butylcarbamoyl]propyl]thiophene-2-carboxamide Formula: C25H36N4O2S MolecularWeight: 456.64394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCCCNC(=O)C(C(C)C)NC(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCCNC(=O)C(C(C)C)NC(=O)C3=CC=CS3

InChI

InChI=1S/C25H36N4O2S/c1-19(2)23(27-24(30)22-10-7-17-32-22)25(31)26-11-4-5-12-28-13-15-29(16-14-28)21-9-6-8-20(3)18-21/h6-10,17-19,23H,4-5,11-16H2,1-3H3,(H,26,31)(H,27,30)