N-[5-[(3-methoxyphenyl)methyl]-1,3-thiazol-2-yl]-4-(prop-2-ynylsulfamoyl)benzamide

Systemtic Name: N-[5-[(3-methoxyphenyl)methyl]-1,3-thiazol-2-yl]-4-(prop-2-ynylsulfamoyl)benzamide Openeye Name: N-[5-[(3-methoxyphenyl)methyl]thiazol-2-yl]-4-(prop-2-ynylsulfamoyl)benzamide CAS Name: N-[5-[(3-methoxyphenyl)methyl]-2-thiazolyl]-4-(prop-2-ynylsulfamoyl)benzamide IUPAC Name: N-[5-[(3-methoxyphenyl)methyl]-1,3-thiazol-2-yl]-4-(prop-2-ynylsulfamoyl)benzamide Traditional Name: N-(5-m-anisylthiazol-2-yl)-4-(propargylsulfamoyl)benzamide Formula: C21H19N3O4S2 MolecularWeight: 441.52326

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CC2=CN=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)NCC#C

Isomeric SMILES

COC1=CC=CC(=C1)CC2=CN=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)NCC#C

InChI

InChI=1S/C21H19N3O4S2/c1-3-11-23-30(26,27)19-9-7-16(8-10-19)20(25)24-21-22-14-18(29-21)13-15-5-4-6-17(12-15)28-2/h1,4-10,12,14,23H,11,13H2,2H3,(H,22,24,25)