methyl 2-[5-chloranyl-4-methyl-2-[(E)-3-thiophen-2-ylprop-2-enoyl]imino-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[5-chloranyl-4-methyl-2-[(E)-3-thiophen-2-ylprop-2-enoyl]imino-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[5-chloro-4-methyl-2-[(E)-3-(2-thienyl)prop-2-enoyl]imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[5-chloro-4-methyl-2-[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[5-chloro-4-methyl-2-[(E)-3-thiophen-2-ylprop-2-enoyl]imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[5-chloro-4-methyl-2-[(E)-3-(2-thienyl)acryloyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C18H15ClN2O3S2 MolecularWeight: 406.9063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N(C(=NC(=O)C=CC3=CC=CS3)S2)CC(=O)OC)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N(C(=NC(=O)/C=C/C3=CC=CS3)S2)CC(=O)OC)Cl

InChI

InChI=1S/C18H15ClN2O3S2/c1-11-13(19)6-7-14-17(11)21(10-16(23)24-2)18(26-14)20-15(22)8-5-12-4-3-9-25-12/h3-9H,10H2,1-2H3/b8-5+,20-18?