azepan-1-yl-[4-(2,3-dihydroindol-1-ylsulfonyl)-1,2,5-trimethyl-pyrrol-3-yl]methanone

Systemtic Name: azepan-1-yl-[4-(2,3-dihydroindol-1-ylsulfonyl)-1,2,5-trimethyl-pyrrol-3-yl]methanone Openeye Name: azepan-1-yl-(4-indolin-1-ylsulfonyl-1,2,5-trimethyl-pyrrol-3-yl)methanone CAS Name: 1-azepanyl-[4-(2,3-dihydroindol-1-ylsulfonyl)-1,2,5-trimethyl-3-pyrrolyl]methanone IUPAC Name: azepan-1-yl-[4-(2,3-dihydroindol-1-ylsulfonyl)-1,2,5-trimethylpyrrol-3-yl]methanone Traditional Name: azepan-1-yl-(4-indolin-1-ylsulfonyl-1,2,5-trimethyl-pyrrol-3-yl)methanone Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1C)C)S(=O)(=O)N2CCC3=CC=CC=C32)C(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C(=C(N1C)C)S(=O)(=O)N2CCC3=CC=CC=C32)C(=O)N4CCCCCC4

InChI

InChI=1S/C22H29N3O3S/c1-16-20(22(26)24-13-8-4-5-9-14-24)21(17(2)23(16)3)29(27,28)25-15-12-18-10-6-7-11-19(18)25/h6-7,10-11H,4-5,8-9,12-15H2,1-3H3