N-(5-chloranyl-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-4-phenylsulfanyl-butanamide

Systemtic Name: N-(5-chloranyl-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-4-phenylsulfanyl-butanamide Openeye Name: N-(5-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-4-phenylsulfanyl-butanamide CAS Name: N-(5-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-4-(phenylthio)butanamide IUPAC Name: N-(5-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-4-phenylsulfanylbutanamide Traditional Name: N-(5-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-4-(phenylthio)butyramide Formula: C19H19ClN2OS2 MolecularWeight: 390.94996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N(C(=NC(=O)CCCSC3=CC=CC=C3)S2)C)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N(C(=NC(=O)CCCSC3=CC=CC=C3)S2)C)Cl

InChI

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