1-(2,3-dihydroindol-1-yl)-2-[(2-phenyl-1,3-thiazol-4-yl)methylsulfonyl]propan-1-one

Systemtic Name: 1-(2,3-dihydroindol-1-yl)-2-[(2-phenyl-1,3-thiazol-4-yl)methylsulfonyl]propan-1-one Openeye Name: 1-indolin-1-yl-2-[(2-phenylthiazol-4-yl)methylsulfonyl]propan-1-one CAS Name: 1-(2,3-dihydroindol-1-yl)-2-[(2-phenyl-4-thiazolyl)methylsulfonyl]-1-propanone IUPAC Name: 1-(2,3-dihydroindol-1-yl)-2-[(2-phenyl-1,3-thiazol-4-yl)methylsulfonyl]propan-1-one Traditional Name: 1-indolin-1-yl-2-[(2-phenylthiazol-4-yl)methylsulfonyl]propan-1-one Formula: C21H20N2O3S2 MolecularWeight: 412.5251

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC2=CC=CC=C21)S(=O)(=O)CC3=CSC(=N3)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)N1CCC2=CC=CC=C21)S(=O)(=O)CC3=CSC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C21H20N2O3S2/c1-15(21(24)23-12-11-16-7-5-6-10-19(16)23)28(25,26)14-18-13-27-20(22-18)17-8-3-2-4-9-17/h2-10,13,15H,11-12,14H2,1H3