4-(4-methylphenyl)sulfonyl-N-(oxolan-2-ylmethyl)-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: 4-(4-methylphenyl)sulfonyl-N-(oxolan-2-ylmethyl)-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)butanamide Openeye Name: N-(4-isopropyl-1,3-benzothiazol-2-yl)-4-(p-tolylsulfonyl)-N-(tetrahydrofuran-2-ylmethyl)butanamide CAS Name: 4-(4-methylphenyl)sulfonyl-N-(2-oxolanylmethyl)-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)butanamide IUPAC Name: 4-(4-methylphenyl)sulfonyl-N-(oxolan-2-ylmethyl)-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)butanamide Traditional Name: N-(4-isopropyl-1,3-benzothiazol-2-yl)-N-(tetrahydrofurfuryl)-4-tosyl-butyramide Formula: C26H32N2O4S2 MolecularWeight: 500.67328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCCC(=O)N(CC2CCCO2)C3=NC4=C(C=CC=C4S3)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCCC(=O)N(CC2CCCO2)C3=NC4=C(C=CC=C4S3)C(C)C

InChI

InChI=1S/C26H32N2O4S2/c1-18(2)22-8-4-9-23-25(22)27-26(33-23)28(17-20-7-5-15-32-20)24(29)10-6-16-34(30,31)21-13-11-19(3)12-14-21/h4,8-9,11-14,18,20H,5-7,10,15-17H2,1-3H3