3-(1-methyl-2,3,4,7-tetrahydroazepin-5-yl)-1-(phenylsulfonyl)indole

Systemtic Name: 3-(1-methyl-2,3,4,7-tetrahydroazepin-5-yl)-1-(phenylsulfonyl)indole Openeye Name: 1-(benzenesulfonyl)-3-(1-methyl-2,3,4,7-tetrahydroazepin-5-yl)indole CAS Name: 1-(benzenesulfonyl)-3-(1-methyl-2,3,4,7-tetrahydroazepin-5-yl)indole IUPAC Name: 1-(benzenesulfonyl)-3-(1-methyl-2,3,4,7-tetrahydroazepin-5-yl)indole Traditional Name: 1-besyl-3-(1-methyl-2,3,4,7-tetrahydroazepin-5-yl)indole Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(=CC1)C2=CN(C3=CC=CC=C32)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CN1CCCC(=CC1)C2=CN(C3=CC=CC=C32)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H22N2O2S/c1-22-14-7-8-17(13-15-22)20-16-23(21-12-6-5-11-19(20)21)26(24,25)18-9-3-2-4-10-18/h2-6,9-13,16H,7-8,14-15H2,1H3