[4-(4-methylphenyl)carbonylpiperazin-1-yl]-[(2S)-1-thiophen-2-ylcarbonylpyrrolidin-2-yl]methanone

Systemtic Name: [4-(4-methylphenyl)carbonylpiperazin-1-yl]-[(2S)-1-thiophen-2-ylcarbonylpyrrolidin-2-yl]methanone Openeye Name: [4-(4-methylbenzoyl)piperazin-1-yl]-[(2S)-1-(thiophene-2-carbonyl)pyrrolidin-2-yl]methanone CAS Name: [4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]-[(2S)-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinyl]methanone IUPAC Name: [4-(4-methylbenzoyl)piperazin-1-yl]-[(2S)-1-(thiophene-2-carbonyl)pyrrolidin-2-yl]methanone Traditional Name: (4-p-toluoylpiperazino)-[(2S)-1-(2-thenoyl)pyrrolidin-2-yl]methanone Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3CCCN3C(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)[C@@H]3CCCN3C(=O)C4=CC=CS4

InChI

InChI=1S/C22H25N3O3S/c1-16-6-8-17(9-7-16)20(26)23-11-13-24(14-12-23)21(27)18-4-2-10-25(18)22(28)19-5-3-15-29-19/h3,5-9,15,18H,2,4,10-14H2,1H3/t18-/m0/s1