4-(1-methylindol-5-yl)sulfonyl-N-(3-methylsulfanylphenyl)piperazine-1-carboxamide

Systemtic Name: 4-(1-methylindol-5-yl)sulfonyl-N-(3-methylsulfanylphenyl)piperazine-1-carboxamide Openeye Name: 4-(1-methylindol-5-yl)sulfonyl-N-(3-methylsulfanylphenyl)piperazine-1-carboxamide CAS Name: 4-[(1-methyl-5-indolyl)sulfonyl]-N-[3-(methylthio)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-(1-methylindol-5-yl)sulfonyl-N-(3-methylsulfanylphenyl)piperazine-1-carboxamide Traditional Name: 4-(1-methylindol-5-yl)sulfonyl-N-[3-(methylthio)phenyl]piperazine-1-carboxamide Formula: C21H24N4O3S2 MolecularWeight: 444.57026

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCN(CC3)C(=O)NC4=CC(=CC=C4)SC

Isomeric SMILES

CN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCN(CC3)C(=O)NC4=CC(=CC=C4)SC

InChI

InChI=1S/C21H24N4O3S2/c1-23-9-8-16-14-19(6-7-20(16)23)30(27,28)25-12-10-24(11-13-25)21(26)22-17-4-3-5-18(15-17)29-2/h3-9,14-15H,10-13H2,1-2H3,(H,22,26)