N-(6-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-(phenylmethyl)sulfonyl-propanamide

Systemtic Name: N-(6-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-(phenylmethyl)sulfonyl-propanamide Openeye Name: 3-benzylsulfonyl-N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)propanamide CAS Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-3-(phenylmethyl)sulfonylpropanamide IUPAC Name: 3-benzylsulfonyl-N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)propanamide Traditional Name: 3-benzylsulfonyl-N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-furfuryl)propionamide Formula: C23H21ClN2O4S2 MolecularWeight: 489.00684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1N=C(S2)N(CC3=CC=CO3)C(=O)CCS(=O)(=O)CC4=CC=CC=C4)Cl

Isomeric SMILES

CC1=CC(=CC2=C1N=C(S2)N(CC3=CC=CO3)C(=O)CCS(=O)(=O)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C23H21ClN2O4S2/c1-16-12-18(24)13-20-22(16)25-23(31-20)26(14-19-8-5-10-30-19)21(27)9-11-32(28,29)15-17-6-3-2-4-7-17/h2-8,10,12-13H,9,11,14-15H2,1H3