2-[[(S)-(4-methylphenyl)-thiophen-2-yl-methyl]amino]-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[[(S)-(4-methylphenyl)-thiophen-2-yl-methyl]amino]-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[[(S)-p-tolyl(2-thienyl)methyl]amino]-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-[[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]amino]-N-[4-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]amino]-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[[(S)-p-tolyl(2-thienyl)methyl]amino]-N-(4-pyrrolidinosulfonylphenyl)acetamide Formula: C24H27N3O3S2 MolecularWeight: 469.61948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)NCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H](C2=CC=CS2)NCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C24H27N3O3S2/c1-18-6-8-19(9-7-18)24(22-5-4-16-31-22)25-17-23(28)26-20-10-12-21(13-11-20)32(29,30)27-14-2-3-15-27/h4-13,16,24-25H,2-3,14-15,17H2,1H3,(H,26,28)/t24-/m0/s1