N-(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-3-propan-2-ylsulfonyl-benzamide

Systemtic Name: N-(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-3-propan-2-ylsulfonyl-benzamide Openeye Name: N-benzyl-N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-3-isopropylsulfonyl-benzamide CAS Name: N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-3-propan-2-ylsulfonylbenzamide IUPAC Name: N-benzyl-N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-3-propan-2-ylsulfonylbenzamide Traditional Name: N-benzyl-N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-3-isopropylsulfonyl-benzamide Formula: C25H23ClN2O4S2 MolecularWeight: 515.04412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)N(CC2=CC=CC=C2)C3=NC4=C(C=CC(=C4S3)Cl)OC

Isomeric SMILES

CC(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)N(CC2=CC=CC=C2)C3=NC4=C(C=CC(=C4S3)Cl)OC

InChI

InChI=1S/C25H23ClN2O4S2/c1-16(2)34(30,31)19-11-7-10-18(14-19)24(29)28(15-17-8-5-4-6-9-17)25-27-22-21(32-3)13-12-20(26)23(22)33-25/h4-14,16H,15H2,1-3H3