N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-1-benzothiophene-3-sulfonamide

Systemtic Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-1-benzothiophene-3-sulfonamide Openeye Name: N-[4-(1-adamantyl)thiazol-2-yl]benzothiophene-3-sulfonamide CAS Name: N-[4-(1-adamantyl)-2-thiazolyl]-1-benzothiophene-3-sulfonamide IUPAC Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-1-benzothiophene-3-sulfonamide Traditional Name: N-[4-(1-adamantyl)thiazol-2-yl]benzothiophene-3-sulfonamide Formula: C21H22N2O2S3 MolecularWeight: 430.60658

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CSC(=N4)NS(=O)(=O)C5=CSC6=CC=CC=C65

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CSC(=N4)NS(=O)(=O)C5=CSC6=CC=CC=C65

InChI

InChI=1S/C21H22N2O2S3/c24-28(25,18-11-26-17-4-2-1-3-16(17)18)23-20-22-19(12-27-20)21-8-13-5-14(9-21)7-15(6-13)10-21/h1-4,11-15H,5-10H2,(H,22,23)