4-[2-[[3-(azepan-1-ylsulfonyl)phenyl]amino]ethanoylamino]benzamide

Systemtic Name: 4-[2-[[3-(azepan-1-ylsulfonyl)phenyl]amino]ethanoylamino]benzamide Openeye Name: 4-[[2-[3-(azepan-1-ylsulfonyl)anilino]acetyl]amino]benzamide CAS Name: 4-[[2-[3-(1-azepanylsulfonyl)anilino]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[3-(azepan-1-ylsulfonyl)anilino]acetyl]amino]benzamide Traditional Name: 4-[[2-[3-(azepan-1-ylsulfonyl)anilino]acetyl]amino]benzamide Formula: C21H26N4O4S MolecularWeight: 430.52054

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NCC(=O)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NCC(=O)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C21H26N4O4S/c22-21(27)16-8-10-17(11-9-16)24-20(26)15-23-18-6-5-7-19(14-18)30(28,29)25-12-3-1-2-4-13-25/h5-11,14,23H,1-4,12-13,15H2,(H2,22,27)(H,24,26)