1-(5-bromanyl-2-methoxy-phenyl)sulfonyl-4-(phenylmethyl)-1,4-diazepane

Systemtic Name: 1-(5-bromanyl-2-methoxy-phenyl)sulfonyl-4-(phenylmethyl)-1,4-diazepane Openeye Name: 1-benzyl-4-(5-bromo-2-methoxy-phenyl)sulfonyl-1,4-diazepane CAS Name: 1-(5-bromo-2-methoxyphenyl)sulfonyl-4-(phenylmethyl)-1,4-diazepane IUPAC Name: 1-benzyl-4-(5-bromo-2-methoxyphenyl)sulfonyl-1,4-diazepane Traditional Name: 1-benzyl-4-(5-bromo-2-methoxy-phenyl)sulfonyl-1,4-diazepane Formula: C19H23BrN2O3S MolecularWeight: 439.36652

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C19H23BrN2O3S/c1-25-18-9-8-17(20)14-19(18)26(23,24)22-11-5-10-21(12-13-22)15-16-6-3-2-4-7-16/h2-4,6-9,14H,5,10-13,15H2,1H3