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

Systemtic Name: S-methyl N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl]carbamothioate Openeye Name: S-methyl N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl]carbamothioate CAS Name: N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methylphenyl]carbamothioic acid S-methyl ester IUPAC Name: S-methyl N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methylphenyl]carbamothioate Traditional Name: N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl]thiocarbamic acid S-methyl ester Formula: C17H16N2O2S2 MolecularWeight: 344.45114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O2S2/c1-11-9-12(7-8-13(11)19-17(20)22-2)21-10-16-18-14-5-3-4-6-15(14)23-16/h3-9H,10H2,1-2H3,(H,19,20)