N-[4-(tert-butylcarbamoyl)phenyl]-3-pyrrolidin-1-ylsulfonyl-thiophene-2-carboxamide

Systemtic Name: N-[4-(tert-butylcarbamoyl)phenyl]-3-pyrrolidin-1-ylsulfonyl-thiophene-2-carboxamide Openeye Name: N-[4-(tert-butylcarbamoyl)phenyl]-3-pyrrolidin-1-ylsulfonyl-thiophene-2-carboxamide CAS Name: N-[4-[(tert-butylamino)-oxomethyl]phenyl]-3-(1-pyrrolidinylsulfonyl)-2-thiophenecarboxamide IUPAC Name: N-[4-(tert-butylcarbamoyl)phenyl]-3-pyrrolidin-1-ylsulfonylthiophene-2-carboxamide Traditional Name: N-[4-(tert-butylcarbamoyl)phenyl]-3-pyrrolidinosulfonyl-thiophene-2-carboxamide Formula: C20H25N3O4S2 MolecularWeight: 435.5602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=CS2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=CS2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H25N3O4S2/c1-20(2,3)22-18(24)14-6-8-15(9-7-14)21-19(25)17-16(10-13-28-17)29(26,27)23-11-4-5-12-23/h6-10,13H,4-5,11-12H2,1-3H3,(H,21,25)(H,22,24)