N-[5-[(3-chloranyl-4-methyl-phenyl)methyl]-1,3-thiazol-2-yl]-3-(1-methylidene-3-oxidanylidene-isoindol-2-yl)propanamide

Systemtic Name: N-[5-[(3-chloranyl-4-methyl-phenyl)methyl]-1,3-thiazol-2-yl]-3-(1-methylidene-3-oxidanylidene-isoindol-2-yl)propanamide Openeye Name: N-[5-[(3-chloro-4-methyl-phenyl)methyl]thiazol-2-yl]-3-(1-methylene-3-oxo-isoindolin-2-yl)propanamide CAS Name: N-[5-[(3-chloro-4-methylphenyl)methyl]-2-thiazolyl]-3-(1-methylene-3-oxo-2-isoindolyl)propanamide IUPAC Name: N-[5-[(3-chloro-4-methylphenyl)methyl]-1,3-thiazol-2-yl]-3-(1-methylidene-3-oxoisoindol-2-yl)propanamide Traditional Name: N-[5-(3-chloro-4-methyl-benzyl)thiazol-2-yl]-3-(1-keto-3-methylene-isoindolin-2-yl)propionamide Formula: C23H20ClN3O2S MolecularWeight: 437.9418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CC2=CN=C(S2)NC(=O)CCN3C(=C)C4=CC=CC=C4C3=O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)CC2=CN=C(S2)NC(=O)CCN3C(=C)C4=CC=CC=C4C3=O)Cl

InChI

InChI=1S/C23H20ClN3O2S/c1-14-7-8-16(12-20(14)24)11-17-13-25-23(30-17)26-21(28)9-10-27-15(2)18-5-3-4-6-19(18)22(27)29/h3-8,12-13H,2,9-11H2,1H3,(H,25,26,28)