2-[2-[(4Z)-4-(3H-1,3-benzothiazol-2-ylidene)-4-cyano-3-oxidanylidene-butan-2-yl]sulfanyl-4-methyl-1,3-thiazol-5-yl]ethanamide

Systemtic Name: 2-[2-[(4Z)-4-(3H-1,3-benzothiazol-2-ylidene)-4-cyano-3-oxidanylidene-butan-2-yl]sulfanyl-4-methyl-1,3-thiazol-5-yl]ethanamide Openeye Name: 2-[2-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-3-cyano-1-methyl-2-oxo-propyl]sulfanyl-4-methyl-thiazol-5-yl]acetamide CAS Name: 2-[2-[[(4Z)-4-(3H-1,3-benzothiazol-2-ylidene)-4-cyano-3-oxobutan-2-yl]thio]-4-methyl-5-thiazolyl]acetamide IUPAC Name: 2-[2-[(4Z)-4-(3H-1,3-benzothiazol-2-ylidene)-4-cyano-3-oxobutan-2-yl]sulfanyl-4-methyl-1,3-thiazol-5-yl]acetamide Traditional Name: 2-[2-[[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-3-cyano-2-keto-1-methyl-propyl]thio]-4-methyl-thiazol-5-yl]acetamide Formula: C18H16N4O2S3 MolecularWeight: 416.54024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)SC(C)C(=O)C(=C2NC3=CC=CC=C3S2)C#N)CC(=O)N

Isomeric SMILES

CC1=C(SC(=N1)SC(C)C(=O)/C(=C\2/NC3=CC=CC=C3S2)/C#N)CC(=O)N

InChI

InChI=1S/C18H16N4O2S3/c1-9-14(7-15(20)23)27-18(21-9)25-10(2)16(24)11(8-19)17-22-12-5-3-4-6-13(12)26-17/h3-6,10,22H,7H2,1-2H3,(H2,20,23)/b17-11-