5-(azepan-1-ylsulfonyl)-2-(2,5-dimethylthiophen-3-yl)-1H-indole-3-carbaldehyde

Systemtic Name: 5-(azepan-1-ylsulfonyl)-2-(2,5-dimethylthiophen-3-yl)-1H-indole-3-carbaldehyde Openeye Name: 5-(azepan-1-ylsulfonyl)-2-(2,5-dimethyl-3-thienyl)-1H-indole-3-carbaldehyde CAS Name: 5-(1-azepanylsulfonyl)-2-(2,5-dimethyl-3-thiophenyl)-1H-indole-3-carboxaldehyde IUPAC Name: 5-(azepan-1-ylsulfonyl)-2-(2,5-dimethylthiophen-3-yl)-1H-indole-3-carbaldehyde Traditional Name: 5-(azepan-1-ylsulfonyl)-2-(2,5-dimethyl-3-thienyl)-1H-indole-3-carbaldehyde Formula: C21H24N2O3S2 MolecularWeight: 416.55686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C2=C(C3=C(N2)C=CC(=C3)S(=O)(=O)N4CCCCCC4)C=O

Isomeric SMILES

CC1=CC(=C(S1)C)C2=C(C3=C(N2)C=CC(=C3)S(=O)(=O)N4CCCCCC4)C=O

InChI

InChI=1S/C21H24N2O3S2/c1-14-11-17(15(2)27-14)21-19(13-24)18-12-16(7-8-20(18)22-21)28(25,26)23-9-5-3-4-6-10-23/h7-8,11-13,22H,3-6,9-10H2,1-2H3