4-(azepan-1-ylsulfonyl)-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]benzamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-[(4S)-chroman-4-yl]benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-[(4S)-3,4-dihydro-2H-1-benzopyran-4-yl]benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]benzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-[(4S)-chroman-4-yl]benzamide Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3CCOC4=CC=CC=C34

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N[C@H]3CCOC4=CC=CC=C34

InChI

InChI=1S/C22H26N2O4S/c25-22(23-20-13-16-28-21-8-4-3-7-19(20)21)17-9-11-18(12-10-17)29(26,27)24-14-5-1-2-6-15-24/h3-4,7-12,20H,1-2,5-6,13-16H2,(H,23,25)/t20-/m0/s1