3-[[4-(azepan-1-ylsulfonyl)phenyl]amino]indol-2-one

Systemtic Name: 3-[[4-(azepan-1-ylsulfonyl)phenyl]amino]indol-2-one Openeye Name: 3-[4-(azepan-1-ylsulfonyl)anilino]indol-2-one CAS Name: 3-[4-(1-azepanylsulfonyl)anilino]-2-indolone IUPAC Name: 3-[4-(azepan-1-ylsulfonyl)anilino]indol-2-one Traditional Name: 3-[4-(azepan-1-ylsulfonyl)anilino]indol-2-one Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC3=C4C=CC=CC4=NC3=O

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC3=C4C=CC=CC4=NC3=O

InChI

InChI=1S/C20H21N3O3S/c24-20-19(17-7-3-4-8-18(17)22-20)21-15-9-11-16(12-10-15)27(25,26)23-13-5-1-2-6-14-23/h3-4,7-12H,1-2,5-6,13-14H2,(H,21,22,24)