S-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl] carbamothioate

Systemtic Name: S-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl] carbamothioate Openeye Name: S-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl] carbamothioate CAS Name: carbamothioic acid S-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methylphenyl] ester IUPAC Name: S-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methylphenyl] carbamothioate Traditional Name: thiocarbamic acid S-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl] ester Formula: C16H14N2O2S2 MolecularWeight: 330.42456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=NC3=CC=CC=C3S2)SC(=O)N

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=NC3=CC=CC=C3S2)SC(=O)N

InChI

InChI=1S/C16H14N2O2S2/c1-10-8-11(6-7-13(10)22-16(17)19)20-9-15-18-12-4-2-3-5-14(12)21-15/h2-8H,9H2,1H3,(H2,17,19)