methyl 2-[2-(5-chloranylthiophen-2-yl)carbonylimino-4-methyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[2-(5-chloranylthiophen-2-yl)carbonylimino-4-methyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-(5-chlorothiophene-2-carbonyl)imino-4-methyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[(5-chloro-2-thiophenyl)-oxomethyl]imino-4-methyl-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(5-chlorothiophene-2-carbonyl)imino-4-methyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-(5-chlorothiophene-2-carbonyl)imino-4-methyl-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C16H13ClN2O3S2 MolecularWeight: 380.86902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=NC(=O)C3=CC=C(S3)Cl)N2CC(=O)OC

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=NC(=O)C3=CC=C(S3)Cl)N2CC(=O)OC

InChI

InChI=1S/C16H13ClN2O3S2/c1-9-4-3-5-10-14(9)19(8-13(20)22-2)16(24-10)18-15(21)11-6-7-12(17)23-11/h3-7H,8H2,1-2H3