methyl 2-[(E)-3-(2-chlorophenyl)prop-2-enoyl]imino-3-ethyl-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-[(E)-3-(2-chlorophenyl)prop-2-enoyl]imino-3-ethyl-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-[(E)-3-(2-chlorophenyl)prop-2-enoyl]imino-3-ethyl-1,3-benzothiazole-6-carboxylate CAS Name: 2-[(E)-3-(2-chlorophenyl)-1-oxoprop-2-enyl]imino-3-ethyl-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[(E)-3-(2-chlorophenyl)prop-2-enoyl]imino-3-ethyl-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(E)-3-(2-chlorophenyl)acryloyl]imino-3-ethyl-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C20H17ClN2O3S MolecularWeight: 400.87858

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)C=CC3=CC=CC=C3Cl

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)/C=C/C3=CC=CC=C3Cl

InChI

InChI=1S/C20H17ClN2O3S/c1-3-23-16-10-8-14(19(25)26-2)12-17(16)27-20(23)22-18(24)11-9-13-6-4-5-7-15(13)21/h4-12H,3H2,1-2H3/b11-9+,22-20?