N-(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-(phenylmethyl)sulfonyl-butanamide

Systemtic Name: N-(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-(phenylmethyl)sulfonyl-butanamide Openeye Name: 4-benzylsulfonyl-N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)butanamide CAS Name: N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-4-(phenylmethyl)sulfonylbutanamide IUPAC Name: 4-benzylsulfonyl-N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)butanamide Traditional Name: 4-benzylsulfonyl-N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(2-furfuryl)butyramide Formula: C24H23ClN2O5S2 MolecularWeight: 519.03282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)Cl)SC(=N2)N(CC3=CC=CO3)C(=O)CCCS(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

COC1=C2C(=C(C=C1)Cl)SC(=N2)N(CC3=CC=CO3)C(=O)CCCS(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C24H23ClN2O5S2/c1-31-20-12-11-19(25)23-22(20)26-24(33-23)27(15-18-9-5-13-32-18)21(28)10-6-14-34(29,30)16-17-7-3-2-4-8-17/h2-5,7-9,11-13H,6,10,14-16H2,1H3