N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)ethanamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)ethanamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[2-(2-thienyl)thiazol-4-yl]acetamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-2-(2-thiophen-2-yl-4-thiazolyl)acetamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)acetamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[2-(2-thienyl)thiazol-4-yl]acetamide Formula: C21H23N3O3S3 MolecularWeight: 461.62062

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CC3=CSC(=N3)C4=CC=CS4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CC3=CSC(=N3)C4=CC=CS4

InChI

InChI=1S/C21H23N3O3S3/c25-20(14-17-15-29-21(23-17)19-6-5-13-28-19)22-16-7-9-18(10-8-16)30(26,27)24-11-3-1-2-4-12-24/h5-10,13,15H,1-4,11-12,14H2,(H,22,25)