N-[5-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]carbonyl-2-methyl-phenyl]furan-2-carboxamide

Systemtic Name: N-[5-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]carbonyl-2-methyl-phenyl]furan-2-carboxamide Openeye Name: N-[5-[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-2-methyl-phenyl]furan-2-carboxamide CAS Name: N-[5-[[2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-oxomethyl]-2-methylphenyl]-2-furancarboxamide IUPAC Name: N-[5-[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-2-methylphenyl]furan-2-carboxamide Traditional Name: N-[5-[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-2-methyl-phenyl]-2-furamide Formula: C24H21N3O3S MolecularWeight: 431.50684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCCC2C3=NC4=CC=CC=C4S3)NC(=O)C5=CC=CO5

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCCC2C3=NC4=CC=CC=C4S3)NC(=O)C5=CC=CO5

InChI

InChI=1S/C24H21N3O3S/c1-15-10-11-16(14-18(15)25-22(28)20-8-5-13-30-20)24(29)27-12-4-7-19(27)23-26-17-6-2-3-9-21(17)31-23/h2-3,5-6,8-11,13-14,19H,4,7,12H2,1H3,(H,25,28)