1-[[2,6-di(propan-2-yl)phenyl]carbamoyl]pyrrolidine-2-carbothioate

Systemtic Name: 1-[[2,6-di(propan-2-yl)phenyl]carbamoyl]pyrrolidine-2-carbothioate Openeye Name: 1-[(2,6-diisopropylphenyl)carbamoyl]pyrrolidine-2-carbothioate CAS Name: 1-[[2,6-di(propan-2-yl)anilino]-oxomethyl]-2-pyrrolidinecarbothioate IUPAC Name: 1-[[2,6-di(propan-2-yl)phenyl]carbamoyl]pyrrolidine-2-carbothioate Traditional Name: 1-[(2,6-diisopropylphenyl)carbamoyl]pyrrolidine-2-carbothioate Formula: C18H25N2O2S- MolecularWeight: 333.4683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)N2CCCC2C(=S)[O-]

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)N2CCCC2C(=S)[O-]

InChI

InChI=1S/C18H26N2O2S/c1-11(2)13-7-5-8-14(12(3)4)16(13)19-18(22)20-10-6-9-15(20)17(21)23/h5,7-8,11-12,15H,6,9-10H2,1-4H3,(H,19,22)(H,21,23)/p-1