4-[2-[(3-chloranyl-6-methoxy-1-benzothiophen-2-yl)carbonyl]hydrazinyl]-N-(2,5-dimethylphenyl)-4-oxidanylidene-butanamide

Systemtic Name: 4-[2-[(3-chloranyl-6-methoxy-1-benzothiophen-2-yl)carbonyl]hydrazinyl]-N-(2,5-dimethylphenyl)-4-oxidanylidene-butanamide Openeye Name: 4-[2-(3-chloro-6-methoxy-benzothiophene-2-carbonyl)hydrazino]-N-(2,5-dimethylphenyl)-4-oxo-butanamide CAS Name: 4-[[(3-chloro-6-methoxy-1-benzothiophen-2-yl)-oxomethyl]hydrazo]-N-(2,5-dimethylphenyl)-4-oxobutanamide IUPAC Name: 4-[2-(3-chloro-6-methoxy-1-benzothiophene-2-carbonyl)hydrazinyl]-N-(2,5-dimethylphenyl)-4-oxobutanamide Traditional Name: 4-[N'-(3-chloro-6-methoxy-benzothiophene-2-carbonyl)hydrazino]-N-(2,5-dimethylphenyl)-4-keto-butyramide Formula: C22H22ClN3O4S MolecularWeight: 459.94578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CCC(=O)NNC(=O)C2=C(C3=C(S2)C=C(C=C3)OC)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CCC(=O)NNC(=O)C2=C(C3=C(S2)C=C(C=C3)OC)Cl

InChI

InChI=1S/C22H22ClN3O4S/c1-12-4-5-13(2)16(10-12)24-18(27)8-9-19(28)25-26-22(29)21-20(23)15-7-6-14(30-3)11-17(15)31-21/h4-7,10-11H,8-9H2,1-3H3,(H,24,27)(H,25,28)(H,26,29)