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

Systemtic Name: N-[4-[5-(acetamidomethyl)thiophen-2-yl]-1,3-thiazol-2-yl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[4-[5-(acetamidomethyl)-2-thienyl]thiazol-2-yl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[4-[5-(acetamidomethyl)-2-thiophenyl]-2-thiazolyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[4-[5-(acetamidomethyl)thiophen-2-yl]-1,3-thiazol-2-yl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[4-[5-(acetamidomethyl)-2-thienyl]thiazol-2-yl]-3-pyrrolidinosulfonyl-benzamide Formula: C21H22N4O4S3 MolecularWeight: 490.61878

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(S1)C2=CSC(=N2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC(=O)NCC1=CC=C(S1)C2=CSC(=N2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H22N4O4S3/c1-14(26)22-12-16-7-8-19(31-16)18-13-30-21(23-18)24-20(27)15-5-4-6-17(11-15)32(28,29)25-9-2-3-10-25/h4-8,11,13H,2-3,9-10,12H2,1H3,(H,22,26)(H,23,24,27)