(2E,4R)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(1-ethylbenzimidazol-2-yl)sulfanyl-3-oxidanylidene-pentanenitrile

Systemtic Name: (2E,4R)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(1-ethylbenzimidazol-2-yl)sulfanyl-3-oxidanylidene-pentanenitrile Openeye Name: (2E,4R)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(1-ethylbenzimidazol-2-yl)sulfanyl-3-oxo-pentanenitrile CAS Name: (2E,4R)-2-(3H-1,3-benzothiazol-2-ylidene)-4-[(1-ethyl-2-benzimidazolyl)thio]-3-oxopentanenitrile IUPAC Name: (2E,4R)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(1-ethylbenzimidazol-2-yl)sulfanyl-3-oxopentanenitrile Traditional Name: (2E,4R)-2-(3H-1,3-benzothiazol-2-ylidene)-4-[(1-ethylbenzimidazol-2-yl)thio]-3-keto-valeronitrile Formula: C21H18N4OS2 MolecularWeight: 406.52382

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1SC(C)C(=O)C(=C3NC4=CC=CC=C4S3)C#N

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1S[C@H](C)C(=O)/C(=C/3\NC4=CC=CC=C4S3)/C#N

InChI

InChI=1S/C21H18N4OS2/c1-3-25-17-10-6-4-8-15(17)24-21(25)27-13(2)19(26)14(12-22)20-23-16-9-5-7-11-18(16)28-20/h4-11,13,23H,3H2,1-2H3/b20-14+/t13-/m1/s1