6-[4-(1,5-dimethyl-2-phenyl-indol-3-yl)carbonyl-1,4-diazepan-1-yl]-N,N-diethyl-pyridine-3-sulfonamide

Systemtic Name: 6-[4-(1,5-dimethyl-2-phenyl-indol-3-yl)carbonyl-1,4-diazepan-1-yl]-N,N-diethyl-pyridine-3-sulfonamide Openeye Name: 6-[4-(1,5-dimethyl-2-phenyl-indole-3-carbonyl)-1,4-diazepan-1-yl]-N,N-diethyl-pyridine-3-sulfonamide CAS Name: 6-[4-[(1,5-dimethyl-2-phenyl-3-indolyl)-oxomethyl]-1,4-diazepan-1-yl]-N,N-diethyl-3-pyridinesulfonamide IUPAC Name: 6-[4-(1,5-dimethyl-2-phenylindole-3-carbonyl)-1,4-diazepan-1-yl]-N,N-diethylpyridine-3-sulfonamide Traditional Name: 6-[4-(1,5-dimethyl-2-phenyl-indole-3-carbonyl)-1,4-diazepan-1-yl]-N,N-diethyl-pyridine-3-sulfonamide Formula: C31H37N5O3S MolecularWeight: 559.72218

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CN=C(C=C1)N2CCCN(CC2)C(=O)C3=C(N(C4=C3C=C(C=C4)C)C)C5=CC=CC=C5

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CN=C(C=C1)N2CCCN(CC2)C(=O)C3=C(N(C4=C3C=C(C=C4)C)C)C5=CC=CC=C5

InChI

InChI=1S/C31H37N5O3S/c1-5-36(6-2)40(38,39)25-14-16-28(32-22-25)34-17-10-18-35(20-19-34)31(37)29-26-21-23(3)13-15-27(26)33(4)30(29)24-11-8-7-9-12-24/h7-9,11-16,21-22H,5-6,10,17-20H2,1-4H3