N-(1,3-benzothiazol-2-yl)-5-oxidanylidene-1-[(4-propan-2-ylphenyl)methyl]pyrrolidine-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-5-oxidanylidene-1-[(4-propan-2-ylphenyl)methyl]pyrrolidine-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-1-[(4-isopropylphenyl)methyl]-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-5-oxo-1-[(4-propan-2-ylphenyl)methyl]-3-pyrrolidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-5-oxo-1-[(4-propan-2-ylphenyl)methyl]pyrrolidine-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-1-(4-isopropylbenzyl)-5-keto-pyrrolidine-3-carboxamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN2CC(CC2=O)C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN2CC(CC2=O)C(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H23N3O2S/c1-14(2)16-9-7-15(8-10-16)12-25-13-17(11-20(25)26)21(27)24-22-23-18-5-3-4-6-19(18)28-22/h3-10,14,17H,11-13H2,1-2H3,(H,23,24,27)