3-(phenylmethyl)sulfonyl-N-(6-propan-2-yl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-(phenylmethyl)sulfonyl-N-(6-propan-2-yl-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-benzylsulfonyl-N-(6-isopropyl-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-(phenylmethyl)sulfonyl-N-(6-propan-2-yl-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-benzylsulfonyl-N-(6-propan-2-yl-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-benzylsulfonyl-N-(6-isopropyl-1,3-benzothiazol-2-yl)propionamide Formula: C20H22N2O3S2 MolecularWeight: 402.53028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)N=C(S2)NC(=O)CCS(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)N=C(S2)NC(=O)CCS(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C20H22N2O3S2/c1-14(2)16-8-9-17-18(12-16)26-20(21-17)22-19(23)10-11-27(24,25)13-15-6-4-3-5-7-15/h3-9,12,14H,10-11,13H2,1-2H3,(H,21,22,23)