5-(azepan-1-ylsulfonyl)-3-methyl-N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-3-methyl-N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide Openeye Name: 5-(azepan-1-ylsulfonyl)-3-methyl-N-(tetrahydrofuran-2-ylmethyl)-1H-indole-2-carboxamide CAS Name: 5-(1-azepanylsulfonyl)-3-methyl-N-(2-oxolanylmethyl)-1H-indole-2-carboxamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-3-methyl-N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide Traditional Name: 5-(azepan-1-ylsulfonyl)-3-methyl-N-(tetrahydrofurfuryl)-1H-indole-2-carboxamide Formula: C21H29N3O4S MolecularWeight: 419.53766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)S(=O)(=O)N3CCCCCC3)C(=O)NCC4CCCO4

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)S(=O)(=O)N3CCCCCC3)C(=O)NCC4CCCO4

InChI

InChI=1S/C21H29N3O4S/c1-15-18-13-17(29(26,27)24-10-4-2-3-5-11-24)8-9-19(18)23-20(15)21(25)22-14-16-7-6-12-28-16/h8-9,13,16,23H,2-7,10-12,14H2,1H3,(H,22,25)