N-(furan-2-ylmethyl)-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl-(phenylmethyl)amino]ethanamide

Systemtic Name: N-(furan-2-ylmethyl)-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl-(phenylmethyl)amino]ethanamide Openeye Name: 2-[benzyl-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl]amino]-N-(2-furylmethyl)acetamide CAS Name: N-(2-furanylmethyl)-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl-(phenylmethyl)amino]acetamide IUPAC Name: 2-[benzyl-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl]amino]-N-(furan-2-ylmethyl)acetamide Traditional Name: 2-[benzyl-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl]amino]-N-(2-furfuryl)acetamide Formula: C22H21N3O4S2 MolecularWeight: 455.54984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3)CC(=O)NCC4=CC=CO4

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3)CC(=O)NCC4=CC=CO4

InChI

InChI=1S/C22H21N3O4S2/c1-16-24-20-10-9-19(12-21(20)30-16)31(27,28)25(14-17-6-3-2-4-7-17)15-22(26)23-13-18-8-5-11-29-18/h2-12H,13-15H2,1H3,(H,23,26)