(Z)-2-(1,3-benzothiazol-2-yl)-3-(3-bromanyl-4-methoxy-5-oxidanyl-phenyl)prop-2-enenitrile

Systemtic Name: (Z)-2-(1,3-benzothiazol-2-yl)-3-(3-bromanyl-4-methoxy-5-oxidanyl-phenyl)prop-2-enenitrile Openeye Name: (Z)-2-(1,3-benzothiazol-2-yl)-3-(3-bromo-5-hydroxy-4-methoxy-phenyl)prop-2-enenitrile CAS Name: (Z)-2-(1,3-benzothiazol-2-yl)-3-(3-bromo-5-hydroxy-4-methoxyphenyl)-2-propenenitrile IUPAC Name: (Z)-2-(1,3-benzothiazol-2-yl)-3-(3-bromo-5-hydroxy-4-methoxyphenyl)prop-2-enenitrile Traditional Name: (Z)-2-(1,3-benzothiazol-2-yl)-3-(3-bromo-5-hydroxy-4-methoxy-phenyl)acrylonitrile Formula: C17H11BrN2O2S MolecularWeight: 387.25044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Br)C=C(C#N)C2=NC3=CC=CC=C3S2)O

Isomeric SMILES

COC1=C(C=C(C=C1Br)/C=C(/C#N)\C2=NC3=CC=CC=C3S2)O

InChI

InChI=1S/C17H11BrN2O2S/c1-22-16-12(18)7-10(8-14(16)21)6-11(9-19)17-20-13-4-2-3-5-15(13)23-17/h2-8,21H,1H3/b11-6-