methyl (Z)-2-[2-[6-(1,3-benzothiazol-2-ylsulfanyl)pyrimidin-4-yl]oxyphenyl]-3-methoxy-prop-2-enoate

Systemtic Name: methyl (Z)-2-[2-[6-(1,3-benzothiazol-2-ylsulfanyl)pyrimidin-4-yl]oxyphenyl]-3-methoxy-prop-2-enoate Openeye Name: methyl (Z)-2-[2-[6-(1,3-benzothiazol-2-ylsulfanyl)pyrimidin-4-yl]oxyphenyl]-3-methoxy-prop-2-enoate CAS Name: (Z)-2-[2-[[6-(1,3-benzothiazol-2-ylthio)-4-pyrimidinyl]oxy]phenyl]-3-methoxy-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-2-[2-[6-(1,3-benzothiazol-2-ylsulfanyl)pyrimidin-4-yl]oxyphenyl]-3-methoxyprop-2-enoate Traditional Name: (Z)-2-[2-[6-(1,3-benzothiazol-2-ylthio)pyrimidin-4-yl]oxyphenyl]-3-methoxy-acrylic acid methyl ester Formula: C22H17N3O4S2 MolecularWeight: 451.51808

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Descriptors Computed from Structure

Canonical SMILES:

COC=C(C1=CC=CC=C1OC2=CC(=NC=N2)SC3=NC4=CC=CC=C4S3)C(=O)OC

Isomeric SMILES

CO/C=C(/C1=CC=CC=C1OC2=CC(=NC=N2)SC3=NC4=CC=CC=C4S3)\C(=O)OC

InChI

InChI=1S/C22H17N3O4S2/c1-27-12-15(21(26)28-2)14-7-3-5-9-17(14)29-19-11-20(24-13-23-19)31-22-25-16-8-4-6-10-18(16)30-22/h3-13H,1-2H3/b15-12-