[2,3-dimethyl-1-(phenylmethyl)indol-5-yl]-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: [2,3-dimethyl-1-(phenylmethyl)indol-5-yl]-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (1-benzyl-2,3-dimethyl-indol-5-yl)-[4-(2-thienylsulfonyl)piperazin-1-yl]methanone CAS Name: [2,3-dimethyl-1-(phenylmethyl)-5-indolyl]-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methanone IUPAC Name: (1-benzyl-2,3-dimethylindol-5-yl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (1-benzyl-2,3-dimethyl-indol-5-yl)-[4-(2-thienylsulfonyl)piperazino]methanone Formula: C26H27N3O3S2 MolecularWeight: 493.64088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CS4)CC5=CC=CC=C5)C

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CS4)CC5=CC=CC=C5)C

InChI

InChI=1S/C26H27N3O3S2/c1-19-20(2)29(18-21-7-4-3-5-8-21)24-11-10-22(17-23(19)24)26(30)27-12-14-28(15-13-27)34(31,32)25-9-6-16-33-25/h3-11,16-17H,12-15,18H2,1-2H3