methyl 2-[(4-methyl-1,3-benzothiazol-2-yl)carbamothioylamino]ethanoate

Systemtic Name: methyl 2-[(4-methyl-1,3-benzothiazol-2-yl)carbamothioylamino]ethanoate Openeye Name: methyl 2-[(4-methyl-1,3-benzothiazol-2-yl)carbamothioylamino]acetate CAS Name: 2-[[[(4-methyl-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[(4-methyl-1,3-benzothiazol-2-yl)carbamothioylamino]acetate Traditional Name: 2-[(4-methyl-1,3-benzothiazol-2-yl)thiocarbamoylamino]acetic acid methyl ester Formula: C12H13N3O2S2 MolecularWeight: 295.38052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=S)NCC(=O)OC

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=S)NCC(=O)OC

InChI

InChI=1S/C12H13N3O2S2/c1-7-4-3-5-8-10(7)14-12(19-8)15-11(18)13-6-9(16)17-2/h3-5H,6H2,1-2H3,(H2,13,14,15,18)