2-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonylphenyl]sulfanyl-N-(furan-2-ylmethyl)ethanamide

Systemtic Name: 2-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonylphenyl]sulfanyl-N-(furan-2-ylmethyl)ethanamide Openeye Name: 2-[2-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]phenyl]sulfanyl-N-(2-furylmethyl)acetamide CAS Name: 2-[[2-[[4-(2,3-dimethylphenyl)-1-piperazinyl]-oxomethyl]phenyl]thio]-N-(2-furanylmethyl)acetamide IUPAC Name: 2-[2-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]phenyl]sulfanyl-N-(furan-2-ylmethyl)acetamide Traditional Name: 2-[[2-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]phenyl]thio]-N-(2-furfuryl)acetamide Formula: C26H29N3O3S MolecularWeight: 463.59176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3SCC(=O)NCC4=CC=CO4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3SCC(=O)NCC4=CC=CO4)C

InChI

InChI=1S/C26H29N3O3S/c1-19-7-5-10-23(20(19)2)28-12-14-29(15-13-28)26(31)22-9-3-4-11-24(22)33-18-25(30)27-17-21-8-6-16-32-21/h3-11,16H,12-15,17-18H2,1-2H3,(H,27,30)