5-chloranyl-3-methyl-N-[3-(4-methylpiperazin-1-yl)-4-phenylmethoxy-phenyl]-1-benzothiophene-2-sulfonamide

Systemtic Name: 5-chloranyl-3-methyl-N-[3-(4-methylpiperazin-1-yl)-4-phenylmethoxy-phenyl]-1-benzothiophene-2-sulfonamide Openeye Name: N-[4-benzyloxy-3-(4-methylpiperazin-1-yl)phenyl]-5-chloro-3-methyl-benzothiophene-2-sulfonamide CAS Name: 5-chloro-3-methyl-N-[3-(4-methyl-1-piperazinyl)-4-phenylmethoxyphenyl]-1-benzothiophene-2-sulfonamide IUPAC Name: 5-chloro-3-methyl-N-[3-(4-methylpiperazin-1-yl)-4-phenylmethoxyphenyl]-1-benzothiophene-2-sulfonamide Traditional Name: N-[4-benzoxy-3-(4-methylpiperazino)phenyl]-5-chloro-3-methyl-benzothiophene-2-sulfonamide Formula: C27H28ClN3O3S2 MolecularWeight: 542.11252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)Cl)S(=O)(=O)NC3=CC(=C(C=C3)OCC4=CC=CC=C4)N5CCN(CC5)C

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)Cl)S(=O)(=O)NC3=CC(=C(C=C3)OCC4=CC=CC=C4)N5CCN(CC5)C

InChI

InChI=1S/C27H28ClN3O3S2/c1-19-23-16-21(28)8-11-26(23)35-27(19)36(32,33)29-22-9-10-25(34-18-20-6-4-3-5-7-20)24(17-22)31-14-12-30(2)13-15-31/h3-11,16-17,29H,12-15,18H2,1-2H3