N-[4-(4-phenylphenyl)-5-propyl-1,3-thiazol-2-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[4-(4-phenylphenyl)-5-propyl-1,3-thiazol-2-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[4-(4-phenylphenyl)-5-propyl-thiazol-2-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[4-(4-phenylphenyl)-5-propyl-2-thiazolyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[4-(4-phenylphenyl)-5-propyl-1,3-thiazol-2-yl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[4-(4-phenylphenyl)-5-propyl-thiazol-2-yl]-4-pyrrolidinosulfonyl-benzamide Formula: C29H29N3O3S2 MolecularWeight: 531.68886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N=C(S1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CCCC1=C(N=C(S1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H29N3O3S2/c1-2-8-26-27(23-13-11-22(12-14-23)21-9-4-3-5-10-21)30-29(36-26)31-28(33)24-15-17-25(18-16-24)37(34,35)32-19-6-7-20-32/h3-5,9-18H,2,6-8,19-20H2,1H3,(H,30,31,33)