3-[2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]ethanoyl-(4-methoxyphenyl)amino]propanamide

Systemtic Name: 3-[2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]ethanoyl-(4-methoxyphenyl)amino]propanamide Openeye Name: 3-(N-[2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]acetyl]-4-methoxy-anilino)propanamide CAS Name: 3-(N-[2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-1-oxoethyl]-4-methoxyanilino)propanamide IUPAC Name: 3-(N-[2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]acetyl]-4-methoxyanilino)propanamide Traditional Name: 3-(N-[2-[(5-chloro-1,3-benzothiazol-2-yl)thio]acetyl]-4-methoxy-anilino)propionamide Formula: C19H18ClN3O3S2 MolecularWeight: 435.94752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CCC(=O)N)C(=O)CSC2=NC3=C(S2)C=CC(=C3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)N(CCC(=O)N)C(=O)CSC2=NC3=C(S2)C=CC(=C3)Cl

InChI

InChI=1S/C19H18ClN3O3S2/c1-26-14-5-3-13(4-6-14)23(9-8-17(21)24)18(25)11-27-19-22-15-10-12(20)2-7-16(15)28-19/h2-7,10H,8-9,11H2,1H3,(H2,21,24)