methyl N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl]-N-prop-2-ynyl-carbamate

Systemtic Name: methyl N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl]-N-prop-2-ynyl-carbamate Openeye Name: methyl N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl]-N-prop-2-ynyl-carbamate CAS Name: N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methylphenyl]-N-prop-2-ynylcarbamic acid methyl ester IUPAC Name: methyl N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methylphenyl]-N-prop-2-ynylcarbamate Traditional Name: N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl]-N-propargyl-carbamic acid methyl ester Formula: C20H18N2O3S MolecularWeight: 366.43352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18N2O3S/c1-4-11-22(20(23)24-3)17-10-9-15(12-14(17)2)25-13-19-21-16-7-5-6-8-18(16)26-19/h1,5-10,12H,11,13H2,2-3H3