N-acenaphthyleno[1,2-d][1,3]thiazol-8-yl-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-acenaphthyleno[1,2-d][1,3]thiazol-8-yl-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-acenaphthyleno[1,2-d]thiazol-8-yl-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide CAS Name: N-(8-acenaphthyleno[1,2-d]thiazolyl)-1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-acenaphthyleno[1,2-d][1,3]thiazol-8-yl-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: N-acenaphtho[1,2-d]thiazol-8-yl-1-tosyl-pyrrolidine-2-carboxamide Formula: C25H21N3O3S2 MolecularWeight: 475.58254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC3=NC4=C(S3)C5=CC=CC6=C5C4=CC=C6

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC3=NC4=C(S3)C5=CC=CC6=C5C4=CC=C6

InChI

InChI=1S/C25H21N3O3S2/c1-15-10-12-17(13-11-15)33(30,31)28-14-4-9-20(28)24(29)27-25-26-22-18-7-2-5-16-6-3-8-19(21(16)18)23(22)32-25/h2-3,5-8,10-13,20H,4,9,14H2,1H3,(H,26,27,29)