2-(1,3-benzothiazol-2-yl)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]-1-phenyl-prop-2-en-1-one

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]-1-phenyl-prop-2-en-1-one Openeye Name: 2-(1,3-benzothiazol-2-yl)-3-(4-isopentyloxy-3-methoxy-phenyl)-1-phenyl-prop-2-en-1-one CAS Name: 2-(1,3-benzothiazol-2-yl)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]-1-phenyl-2-propen-1-one IUPAC Name: 2-(1,3-benzothiazol-2-yl)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]-1-phenylprop-2-en-1-one Traditional Name: 2-(1,3-benzothiazol-2-yl)-3-(4-isoamoxy-3-methoxy-phenyl)-1-phenyl-prop-2-en-1-one Formula: C28H27NO3S MolecularWeight: 457.58388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C=C(C2=NC3=CC=CC=C3S2)C(=O)C4=CC=CC=C4)OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C=C(C2=NC3=CC=CC=C3S2)C(=O)C4=CC=CC=C4)OC

InChI

InChI=1S/C28H27NO3S/c1-19(2)15-16-32-24-14-13-20(18-25(24)31-3)17-22(27(30)21-9-5-4-6-10-21)28-29-23-11-7-8-12-26(23)33-28/h4-14,17-19H,15-16H2,1-3H3