[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl] N-[[(E)-but-2-enoxy]methyl]carbamate

Systemtic Name: [4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl] N-[[(E)-but-2-enoxy]methyl]carbamate Openeye Name: [4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl] N-[[(E)-but-2-enoxy]methyl]carbamate CAS Name: N-[[(E)-but-2-enoxy]methyl]carbamic acid [4-(1,3-benzothiazol-2-ylmethoxy)-2-methylphenyl] ester IUPAC Name: [4-(1,3-benzothiazol-2-ylmethoxy)-2-methylphenyl] N-[[(E)-but-2-enoxy]methyl]carbamate Traditional Name: N-[[(E)-but-2-enoxy]methyl]carbamic acid [4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl] ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCOCNC(=O)OC1=C(C=C(C=C1)OCC2=NC3=CC=CC=C3S2)C

Isomeric SMILES

C/C=C/COCNC(=O)OC1=C(C=C(C=C1)OCC2=NC3=CC=CC=C3S2)C

InChI

InChI=1S/C21H22N2O4S/c1-3-4-11-25-14-22-21(24)27-18-10-9-16(12-15(18)2)26-13-20-23-17-7-5-6-8-19(17)28-20/h3-10,12H,11,13-14H2,1-2H3,(H,22,24)/b4-3+