O-[3-[[tert-butyl-(3,4-dichlorophenyl)carbonyl-amino]carbamoyl]pyridin-2-yl] methanethioate

Systemtic Name: O-[3-[[tert-butyl-(3,4-dichlorophenyl)carbonyl-amino]carbamoyl]pyridin-2-yl] methanethioate Openeye Name: O-[3-[[tert-butyl-(3,4-dichlorobenzoyl)amino]carbamoyl]-2-pyridyl] methanethioate CAS Name: methanethioic acid O-[3-[[2-tert-butyl-2-[(3,4-dichlorophenyl)-oxomethyl]hydrazinyl]-oxomethyl]-2-pyridinyl] ester IUPAC Name: O-[3-[[tert-butyl-(3,4-dichlorobenzoyl)amino]carbamoyl]pyridin-2-yl] methanethioate Traditional Name: methanethioic acid O-[3-[[tert-butyl-(3,4-dichlorobenzoyl)amino]carbamoyl]-2-pyridyl] ester Formula: C18H17Cl2N3O3S MolecularWeight: 426.31688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(C(=O)C1=CC(=C(C=C1)Cl)Cl)NC(=O)C2=C(N=CC=C2)OC=S

Isomeric SMILES

CC(C)(C)N(C(=O)C1=CC(=C(C=C1)Cl)Cl)NC(=O)C2=C(N=CC=C2)OC=S

InChI

InChI=1S/C18H17Cl2N3O3S/c1-18(2,3)23(17(25)11-6-7-13(19)14(20)9-11)22-15(24)12-5-4-8-21-16(12)26-10-27/h4-10H,1-3H3,(H,22,24)