N-(5-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-4-propan-2-ylsulfonyl-benzamide

Systemtic Name: N-(5-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-4-propan-2-ylsulfonyl-benzamide Openeye Name: N-benzyl-N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-4-isopropylsulfonyl-benzamide CAS Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-4-propan-2-ylsulfonylbenzamide IUPAC Name: N-benzyl-N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-4-propan-2-ylsulfonylbenzamide Traditional Name: N-benzyl-N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-4-isopropylsulfonyl-benzamide Formula: C25H23ClN2O3S2 MolecularWeight: 499.04472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(S2)N(CC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)S(=O)(=O)C(C)C)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(S2)N(CC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)S(=O)(=O)C(C)C)Cl

InChI

InChI=1S/C25H23ClN2O3S2/c1-16(2)33(30,31)20-11-9-19(10-12-20)24(29)28(15-18-7-5-4-6-8-18)25-27-23-17(3)21(26)13-14-22(23)32-25/h4-14,16H,15H2,1-3H3