N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(furan-2-yl)-5-methyl-1,3-thiazole-4-carboxamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(furan-2-yl)-5-methyl-1,3-thiazole-4-carboxamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(2-furyl)-5-methyl-thiazole-4-carboxamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-2-(2-furanyl)-5-methyl-4-thiazolecarboxamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(furan-2-yl)-5-methyl-1,3-thiazole-4-carboxamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(2-furyl)-5-methyl-thiazole-4-carboxamide Formula: C21H23N3O4S2 MolecularWeight: 445.55502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)C2=CC=CO2)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(N=C(S1)C2=CC=CO2)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C21H23N3O4S2/c1-15-19(23-21(29-15)18-10-7-13-28-18)20(25)22-16-8-6-9-17(14-16)30(26,27)24-11-4-2-3-5-12-24/h6-10,13-14H,2-5,11-12H2,1H3,(H,22,25)