2-[2-(4-cyclopropylcarbonylpiperazin-1-yl)carbonylphenyl]sulfanyl-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[2-(4-cyclopropylcarbonylpiperazin-1-yl)carbonylphenyl]sulfanyl-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[2-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]phenyl]sulfanyl-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[[2-[[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]-oxomethyl]phenyl]thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[2-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]phenyl]sulfanyl-1-pyrrolidin-1-ylethanone Traditional Name: 2-[[2-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]phenyl]thio]-1-pyrrolidino-ethanone Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=CC=CC=C2C(=O)N3CCN(CC3)C(=O)C4CC4

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=CC=CC=C2C(=O)N3CCN(CC3)C(=O)C4CC4

InChI

InChI=1S/C21H27N3O3S/c25-19(22-9-3-4-10-22)15-28-18-6-2-1-5-17(18)21(27)24-13-11-23(12-14-24)20(26)16-7-8-16/h1-2,5-6,16H,3-4,7-15H2