4-(1,3-benzothiazol-2-ylsulfanyl)-N-(5-chloranyl-2-methoxy-phenyl)butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(5-chloranyl-2-methoxy-phenyl)butanamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(5-chloro-2-methoxy-phenyl)butanamide CAS Name: 4-(1,3-benzothiazol-2-ylthio)-N-(5-chloro-2-methoxyphenyl)butanamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(5-chloro-2-methoxyphenyl)butanamide Traditional Name: 4-(1,3-benzothiazol-2-ylthio)-N-(5-chloro-2-methoxy-phenyl)butyramide Formula: C18H17ClN2O2S2 MolecularWeight: 392.92278

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)CCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)CCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H17ClN2O2S2/c1-23-15-9-8-12(19)11-14(15)20-17(22)7-4-10-24-18-21-13-5-2-3-6-16(13)25-18/h2-3,5-6,8-9,11H,4,7,10H2,1H3,(H,20,22)