4-[4-(azepan-2-ylmethoxy)indol-1-yl]sulfonylaniline

Systemtic Name: 4-[4-(azepan-2-ylmethoxy)indol-1-yl]sulfonylaniline Openeye Name: 4-[4-(azepan-2-ylmethoxy)indol-1-yl]sulfonylaniline CAS Name: 4-[[4-(2-azepanylmethoxy)-1-indolyl]sulfonyl]aniline IUPAC Name: 4-[4-(azepan-2-ylmethoxy)indol-1-yl]sulfonylaniline Traditional Name: [4-[4-(azepan-2-ylmethoxy)indol-1-yl]sulfonylphenyl]amine Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(NCC1)COC2=CC=CC3=C2C=CN3S(=O)(=O)C4=CC=C(C=C4)N

Isomeric SMILES

C1CCC(NCC1)COC2=CC=CC3=C2C=CN3S(=O)(=O)C4=CC=C(C=C4)N

InChI

InChI=1S/C21H25N3O3S/c22-16-8-10-18(11-9-16)28(25,26)24-14-12-19-20(24)6-4-7-21(19)27-15-17-5-2-1-3-13-23-17/h4,6-12,14,17,23H,1-3,5,13,15,22H2