2-[[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]carbonylamino]-5-phenyl-thiophene-3-carboxamide

Systemtic Name: 2-[[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]carbonylamino]-5-phenyl-thiophene-3-carboxamide Openeye Name: 2-[[4-[(3,5-dimethyl-1-piperidyl)sulfonyl]benzoyl]amino]-5-phenyl-thiophene-3-carboxamide CAS Name: 2-[[[4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]amino]-5-phenyl-3-thiophenecarboxamide IUPAC Name: 2-[[4-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoyl]amino]-5-phenylthiophene-3-carboxamide Traditional Name: 2-[[4-(3,5-dimethylpiperidino)sulfonylbenzoyl]amino]-5-phenyl-thiophene-3-carboxamide Formula: C25H27N3O4S2 MolecularWeight: 497.62958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)N)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)N)C

InChI

InChI=1S/C25H27N3O4S2/c1-16-12-17(2)15-28(14-16)34(31,32)20-10-8-19(9-11-20)24(30)27-25-21(23(26)29)13-22(33-25)18-6-4-3-5-7-18/h3-11,13,16-17H,12,14-15H2,1-2H3,(H2,26,29)(H,27,30)