(Z)-2-[4-(6-bromanyl-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]-3-(3-methoxy-4-phenylmethoxy-phenyl)prop-2-enenitrile

Systemtic Name: (Z)-2-[4-(6-bromanyl-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]-3-(3-methoxy-4-phenylmethoxy-phenyl)prop-2-enenitrile Openeye Name: (Z)-3-(4-benzyloxy-3-methoxy-phenyl)-2-[4-(6-bromo-2-oxo-chromen-3-yl)thiazol-2-yl]prop-2-enenitrile CAS Name: (Z)-2-[4-(6-bromo-2-oxo-1-benzopyran-3-yl)-2-thiazolyl]-3-(3-methoxy-4-phenylmethoxyphenyl)-2-propenenitrile IUPAC Name: (Z)-2-[4-(6-bromo-2-oxochromen-3-yl)-1,3-thiazol-2-yl]-3-(3-methoxy-4-phenylmethoxyphenyl)prop-2-enenitrile Traditional Name: (Z)-3-(4-benzoxy-3-methoxy-phenyl)-2-[4-(6-bromo-2-keto-chromen-3-yl)thiazol-2-yl]acrylonitrile Formula: C29H19BrN2O4S MolecularWeight: 571.44116

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C2=NC(=CS2)C3=CC4=C(C=CC(=C4)Br)OC3=O)OCC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(/C#N)\C2=NC(=CS2)C3=CC4=C(C=CC(=C4)Br)OC3=O)OCC5=CC=CC=C5

InChI

InChI=1S/C29H19BrN2O4S/c1-34-27-12-19(7-9-26(27)35-16-18-5-3-2-4-6-18)11-21(15-31)28-32-24(17-37-28)23-14-20-13-22(30)8-10-25(20)36-29(23)33/h2-14,17H,16H2,1H3/b21-11-