5-chloranyl-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-1H-indole-2-carboxamide

Systemtic Name: 5-chloranyl-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-1H-indole-2-carboxamide Openeye Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-5-chloro-1H-indole-2-carboxamide CAS Name: 5-chloro-3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]-1H-indole-2-carboxamide IUPAC Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-5-chloro-1H-indole-2-carboxamide Traditional Name: 3-(4-benzylpiperazino)sulfonyl-5-chloro-1H-indole-2-carboxamide Formula: C20H21ClN4O3S MolecularWeight: 432.92374

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)C3=C(NC4=C3C=C(C=C4)Cl)C(=O)N

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)C3=C(NC4=C3C=C(C=C4)Cl)C(=O)N

InChI

InChI=1S/C20H21ClN4O3S/c21-15-6-7-17-16(12-15)19(18(23-17)20(22)26)29(27,28)25-10-8-24(9-11-25)13-14-4-2-1-3-5-14/h1-7,12,23H,8-11,13H2,(H2,22,26)