2H-chromen-3-yl-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]methanone

Systemtic Name: 2H-chromen-3-yl-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]methanone Openeye Name: 2H-chromen-3-yl-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]methanone CAS Name: 2H-1-benzopyran-3-yl-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]methanone IUPAC Name: 2H-chromen-3-yl-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]methanone Traditional Name: 2H-chromen-3-yl-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]methanone Formula: C21H21FN2O4S MolecularWeight: 416.465843

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)C3=CC4=CC=CC=C4OC3

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)C3=CC4=CC=CC=C4OC3

InChI

InChI=1S/C21H21FN2O4S/c22-18-6-8-19(9-7-18)29(26,27)24-11-3-10-23(12-13-24)21(25)17-14-16-4-1-2-5-20(16)28-15-17/h1-2,4-9,14H,3,10-13,15H2