O-[3-[[tert-butyl-(2-methylphenyl)carbonyl-amino]carbamoyl]pyridin-2-yl] methanethioate

Systemtic Name: O-[3-[[tert-butyl-(2-methylphenyl)carbonyl-amino]carbamoyl]pyridin-2-yl] methanethioate Openeye Name: O-[3-[[tert-butyl-(2-methylbenzoyl)amino]carbamoyl]-2-pyridyl] methanethioate CAS Name: methanethioic acid O-[3-[[2-tert-butyl-2-[(2-methylphenyl)-oxomethyl]hydrazinyl]-oxomethyl]-2-pyridinyl] ester IUPAC Name: O-[3-[[tert-butyl-(2-methylbenzoyl)amino]carbamoyl]pyridin-2-yl] methanethioate Traditional Name: methanethioic acid O-[3-[[tert-butyl(o-toluoyl)amino]carbamoyl]-2-pyridyl] ester Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N(C(C)(C)C)NC(=O)C2=C(N=CC=C2)OC=S

Isomeric SMILES

CC1=CC=CC=C1C(=O)N(C(C)(C)C)NC(=O)C2=C(N=CC=C2)OC=S

InChI

InChI=1S/C19H21N3O3S/c1-13-8-5-6-9-14(13)18(24)22(19(2,3)4)21-16(23)15-10-7-11-20-17(15)25-12-26/h5-12H,1-4H3,(H,21,23)