N-(3-ethyl-6-propan-2-yl-1,3-benzothiazol-2-ylidene)-3-(phenylsulfonyl)propanamide

Systemtic Name: N-(3-ethyl-6-propan-2-yl-1,3-benzothiazol-2-ylidene)-3-(phenylsulfonyl)propanamide Openeye Name: 3-(benzenesulfonyl)-N-(3-ethyl-6-isopropyl-1,3-benzothiazol-2-ylidene)propanamide CAS Name: 3-(benzenesulfonyl)-N-(3-ethyl-6-propan-2-yl-1,3-benzothiazol-2-ylidene)propanamide IUPAC Name: 3-(benzenesulfonyl)-N-(3-ethyl-6-propan-2-yl-1,3-benzothiazol-2-ylidene)propanamide Traditional Name: 3-besyl-N-(3-ethyl-6-isopropyl-1,3-benzothiazol-2-ylidene)propionamide Formula: C21H24N2O3S2 MolecularWeight: 416.55686

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(C)C)SC1=NC(=O)CCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(C)C)SC1=NC(=O)CCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H24N2O3S2/c1-4-23-18-11-10-16(15(2)3)14-19(18)27-21(23)22-20(24)12-13-28(25,26)17-8-6-5-7-9-17/h5-11,14-15H,4,12-13H2,1-3H3