methyl 4-[[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)carbamothioyl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)carbamothioyl]carbamoyl]benzoate Openeye Name: methyl 4-[[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)carbamothioyl]carbamoyl]benzoate CAS Name: 4-[[[[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]-sulfanylidenemethyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)carbamothioyl]carbamoyl]benzoate Traditional Name: 4-[[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)thiocarbamoyl]carbamoyl]benzoic acid methyl ester Formula: C18H15N3O3S2 MolecularWeight: 385.46

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2SC1=NC(=S)NC(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CN\1C2=CC=CC=C2S/C1=N\C(=S)NC(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C18H15N3O3S2/c1-21-13-5-3-4-6-14(13)26-18(21)20-17(25)19-15(22)11-7-9-12(10-8-11)16(23)24-2/h3-10H,1-2H3,(H,19,22,25)/b20-18-