4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-N-(3-chloranyl-4-methoxy-phenyl)-4-oxidanylidene-butanamide

Systemtic Name: 4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-N-(3-chloranyl-4-methoxy-phenyl)-4-oxidanylidene-butanamide Openeye Name: 4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-N-(3-chloro-4-methoxy-phenyl)-4-oxo-butanamide CAS Name: 4-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]-N-(3-chloro-4-methoxyphenyl)-4-oxobutanamide IUPAC Name: 4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-N-(3-chloro-4-methoxyphenyl)-4-oxobutanamide Traditional Name: 4-[4-(1,2-benzothiazol-3-yl)piperazino]-N-(3-chloro-4-methoxy-phenyl)-4-keto-butyramide Formula: C22H23ClN4O3S MolecularWeight: 458.96102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CCC(=O)N2CCN(CC2)C3=NSC4=CC=CC=C43)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CCC(=O)N2CCN(CC2)C3=NSC4=CC=CC=C43)Cl

InChI

InChI=1S/C22H23ClN4O3S/c1-30-18-7-6-15(14-17(18)23)24-20(28)8-9-21(29)26-10-12-27(13-11-26)22-16-4-2-3-5-19(16)31-25-22/h2-7,14H,8-13H2,1H3,(H,24,28)