1-butyl-N-[4-[(4-methyl-1,3-benzothiazol-2-yl)carbamoyl]phenyl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: 1-butyl-N-[4-[(4-methyl-1,3-benzothiazol-2-yl)carbamoyl]phenyl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: 1-butyl-N-[4-[(4-methyl-1,3-benzothiazol-2-yl)carbamoyl]phenyl]-5-oxo-pyrrolidine-3-carboxamide CAS Name: 1-butyl-N-[4-[[(4-methyl-1,3-benzothiazol-2-yl)amino]-oxomethyl]phenyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: 1-butyl-N-[4-[(4-methyl-1,3-benzothiazol-2-yl)carbamoyl]phenyl]-5-oxopyrrolidine-3-carboxamide Traditional Name: 1-butyl-5-keto-N-[4-[(4-methyl-1,3-benzothiazol-2-yl)carbamoyl]phenyl]pyrrolidine-3-carboxamide Formula: C24H26N4O3S MolecularWeight: 450.55324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)NC3=NC4=C(C=CC=C4S3)C

Isomeric SMILES

CCCCN1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)NC3=NC4=C(C=CC=C4S3)C

InChI

InChI=1S/C24H26N4O3S/c1-3-4-12-28-14-17(13-20(28)29)23(31)25-18-10-8-16(9-11-18)22(30)27-24-26-21-15(2)6-5-7-19(21)32-24/h5-11,17H,3-4,12-14H2,1-2H3,(H,25,31)(H,26,27,30)