4-(phenylsulfonyl)-N-(6-propan-2-yl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)butanamide

Systemtic Name: 4-(phenylsulfonyl)-N-(6-propan-2-yl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)butanamide Openeye Name: 4-(benzenesulfonyl)-N-(6-isopropyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)butanamide CAS Name: 4-(benzenesulfonyl)-N-(6-propan-2-yl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)butanamide IUPAC Name: 4-(benzenesulfonyl)-N-(6-propan-2-yl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)butanamide Traditional Name: 4-besyl-N-(6-isopropyl-3-propargyl-1,3-benzothiazol-2-ylidene)butyramide Formula: C23H24N2O3S2 MolecularWeight: 440.57826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)N(C(=NC(=O)CCCS(=O)(=O)C3=CC=CC=C3)S2)CC#C

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)N(C(=NC(=O)CCCS(=O)(=O)C3=CC=CC=C3)S2)CC#C

InChI

InChI=1S/C23H24N2O3S2/c1-4-14-25-20-13-12-18(17(2)3)16-21(20)29-23(25)24-22(26)11-8-15-30(27,28)19-9-6-5-7-10-19/h1,5-7,9-10,12-13,16-17H,8,11,14-15H2,2-3H3