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

Systemtic Name: propyl N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl]-N-methoxycarbonyl-carbamate Openeye Name: propyl N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl]-N-methoxycarbonyl-carbamate CAS Name: N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methylphenyl]-N-methoxycarbonylcarbamic acid propyl ester IUPAC Name: propyl N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methylphenyl]-N-methoxycarbonylcarbamate Traditional Name: N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl]-N-carbomethoxy-carbamic acid propyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O5S/c1-4-11-27-21(25)23(20(24)26-3)17-10-9-15(12-14(17)2)28-13-19-22-16-7-5-6-8-18(16)29-19/h5-10,12H,4,11,13H2,1-3H3