4-chloranyl-N-[2-(3-methylbutylsulfanyl)-1,3-benzothiazol-6-yl]benzamide

Systemtic Name: 4-chloranyl-N-[2-(3-methylbutylsulfanyl)-1,3-benzothiazol-6-yl]benzamide Openeye Name: 4-chloro-N-(2-isopentylsulfanyl-1,3-benzothiazol-6-yl)benzamide CAS Name: 4-chloro-N-[2-(3-methylbutylthio)-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 4-chloro-N-[2-(3-methylbutylsulfanyl)-1,3-benzothiazol-6-yl]benzamide Traditional Name: 4-chloro-N-[2-(isoamylthio)-1,3-benzothiazol-6-yl]benzamide Formula: C19H19ClN2OS2 MolecularWeight: 390.94996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)CCSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H19ClN2OS2/c1-12(2)9-10-24-19-22-16-8-7-15(11-17(16)25-19)21-18(23)13-3-5-14(20)6-4-13/h3-8,11-12H,9-10H2,1-2H3,(H,21,23)