3-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]-1,3-benzothiazol-2-one

Systemtic Name: 3-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]-1,3-benzothiazol-2-one Openeye Name: 3-[(4-isopentyloxy-3-methoxy-phenyl)methyl]-1,3-benzothiazol-2-one CAS Name: 3-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]-1,3-benzothiazol-2-one IUPAC Name: 3-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]-1,3-benzothiazol-2-one Traditional Name: 3-(4-isoamoxy-3-methoxy-benzyl)-1,3-benzothiazol-2-one Formula: C20H23NO3S MolecularWeight: 357.46652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)CN2C3=CC=CC=C3SC2=O)OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)CN2C3=CC=CC=C3SC2=O)OC

InChI

InChI=1S/C20H23NO3S/c1-14(2)10-11-24-17-9-8-15(12-18(17)23-3)13-21-16-6-4-5-7-19(16)25-20(21)22/h4-9,12,14H,10-11,13H2,1-3H3