[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone

Systemtic Name: [4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone Openeye Name: [4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone CAS Name: [4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-[4-(1-pyrrolidinylsulfonyl)phenyl]methanone IUPAC Name: [4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone Traditional Name: (4-p-anisyl-1,4-diazepan-1-yl)-(4-pyrrolidinosulfonylphenyl)methanone Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C24H31N3O4S/c1-31-22-9-5-20(6-10-22)19-25-13-4-14-26(18-17-25)24(28)21-7-11-23(12-8-21)32(29,30)27-15-2-3-16-27/h5-12H,2-4,13-19H2,1H3