[4-azanyl-2-(phenylmethyl)-5-propan-2-yl-pyrazol-3-yl]-[(2S)-2-[bis(ethylsulfanyl)methyl]pyrrolidin-1-yl]methanone

Systemtic Name: [4-azanyl-2-(phenylmethyl)-5-propan-2-yl-pyrazol-3-yl]-[(2S)-2-[bis(ethylsulfanyl)methyl]pyrrolidin-1-yl]methanone Openeye Name: (4-amino-2-benzyl-5-isopropyl-pyrazol-3-yl)-[(2S)-2-[bis(ethylsulfanyl)methyl]pyrrolidin-1-yl]methanone CAS Name: [4-amino-2-(phenylmethyl)-5-propan-2-yl-3-pyrazolyl]-[(2S)-2-[bis(ethylthio)methyl]-1-pyrrolidinyl]methanone IUPAC Name: (4-amino-2-benzyl-5-propan-2-ylpyrazol-3-yl)-[(2S)-2-[bis(ethylsulfanyl)methyl]pyrrolidin-1-yl]methanone Traditional Name: (4-amino-2-benzyl-5-isopropyl-pyrazol-3-yl)-[(2S)-2-[bis(ethylthio)methyl]pyrrolidino]methanone Formula: C23H34N4OS2 MolecularWeight: 446.67226

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(C1CCCN1C(=O)C2=C(C(=NN2CC3=CC=CC=C3)C(C)C)N)SCC

Isomeric SMILES

CCSC([C@@H]1CCCN1C(=O)C2=C(C(=NN2CC3=CC=CC=C3)C(C)C)N)SCC

InChI

InChI=1S/C23H34N4OS2/c1-5-29-23(30-6-2)18-13-10-14-26(18)22(28)21-19(24)20(16(3)4)25-27(21)15-17-11-8-7-9-12-17/h7-9,11-12,16,18,23H,5-6,10,13-15,24H2,1-4H3/t18-/m0/s1