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

Systemtic Name: N-[5-[(3-chloranyl-4-methyl-phenyl)methyl]-1,3-thiazol-2-yl]-4-(prop-2-ynylsulfamoyl)benzamide Openeye Name: N-[5-[(3-chloro-4-methyl-phenyl)methyl]thiazol-2-yl]-4-(prop-2-ynylsulfamoyl)benzamide CAS Name: N-[5-[(3-chloro-4-methylphenyl)methyl]-2-thiazolyl]-4-(prop-2-ynylsulfamoyl)benzamide IUPAC Name: N-[5-[(3-chloro-4-methylphenyl)methyl]-1,3-thiazol-2-yl]-4-(prop-2-ynylsulfamoyl)benzamide Traditional Name: N-[5-(3-chloro-4-methyl-benzyl)thiazol-2-yl]-4-(propargylsulfamoyl)benzamide Formula: C21H18ClN3O3S2 MolecularWeight: 459.96892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CC2=CN=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)NCC#C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)CC2=CN=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)NCC#C)Cl

InChI

InChI=1S/C21H18ClN3O3S2/c1-3-10-24-30(27,28)18-8-6-16(7-9-18)20(26)25-21-23-13-17(29-21)11-15-5-4-14(2)19(22)12-15/h1,4-9,12-13,24H,10-11H2,2H3,(H,23,25,26)