methyl 2-[methyl-[(2-methyl-3-nitro-phenyl)carbonylcarbamothioyl]amino]ethanoate

Systemtic Name: methyl 2-[methyl-[(2-methyl-3-nitro-phenyl)carbonylcarbamothioyl]amino]ethanoate Openeye Name: methyl 2-[methyl-[(2-methyl-3-nitro-benzoyl)carbamothioyl]amino]acetate CAS Name: 2-[methyl-[[[(2-methyl-3-nitrophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[methyl-[(2-methyl-3-nitrobenzoyl)carbamothioyl]amino]acetate Traditional Name: 2-[methyl-[(2-methyl-3-nitro-benzoyl)thiocarbamoyl]amino]acetic acid methyl ester Formula: C13H15N3O5S MolecularWeight: 325.3403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC(=S)N(C)CC(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC(=S)N(C)CC(=O)OC

InChI

InChI=1S/C13H15N3O5S/c1-8-9(5-4-6-10(8)16(19)20)12(18)14-13(22)15(2)7-11(17)21-3/h4-6H,7H2,1-3H3,(H,14,18,22)