[4-(diphenylmethyl)piperazin-1-yl]-[(2S)-1-thiophen-2-ylcarbonylpyrrolidin-2-yl]methanone

Systemtic Name: [4-(diphenylmethyl)piperazin-1-yl]-[(2S)-1-thiophen-2-ylcarbonylpyrrolidin-2-yl]methanone Openeye Name: (4-benzhydrylpiperazin-1-yl)-[(2S)-1-(thiophene-2-carbonyl)pyrrolidin-2-yl]methanone CAS Name: [4-(diphenylmethyl)-1-piperazinyl]-[(2S)-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinyl]methanone IUPAC Name: (4-benzhydrylpiperazin-1-yl)-[(2S)-1-(thiophene-2-carbonyl)pyrrolidin-2-yl]methanone Traditional Name: (4-benzhydrylpiperazino)-[(2S)-1-(2-thenoyl)pyrrolidin-2-yl]methanone Formula: C27H29N3O2S MolecularWeight: 459.60306

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC=CS2)C(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C2=CC=CS2)C(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H29N3O2S/c31-26(23-13-7-15-30(23)27(32)24-14-8-20-33-24)29-18-16-28(17-19-29)25(21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-6,8-12,14,20,23,25H,7,13,15-19H2/t23-/m0/s1