N-[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)ethanamide

Systemtic Name: N-[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)ethanamide Openeye Name: N-[5-(m-tolylmethyl)thiazol-2-yl]-2-(5-pyrrolidin-1-ylsulfonyl-2-thienyl)acetamide CAS Name: N-[5-[(3-methylphenyl)methyl]-2-thiazolyl]-2-[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]acetamide IUPAC Name: N-[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)acetamide Traditional Name: N-[5-(3-methylbenzyl)thiazol-2-yl]-2-(5-pyrrolidinosulfonyl-2-thienyl)acetamide Formula: C21H23N3O3S3 MolecularWeight: 461.62062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2=CN=C(S2)NC(=O)CC3=CC=C(S3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=CC(=CC=C1)CC2=CN=C(S2)NC(=O)CC3=CC=C(S3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H23N3O3S3/c1-15-5-4-6-16(11-15)12-18-14-22-21(29-18)23-19(25)13-17-7-8-20(28-17)30(26,27)24-9-2-3-10-24/h4-8,11,14H,2-3,9-10,12-13H2,1H3,(H,22,23,25)