3-[2-oxidanylidene-2-[4-(thiophen-3-ylmethyl)-1,4-diazepan-1-yl]ethyl]-4-phenyl-1,3-oxazolidin-2-one

Systemtic Name: 3-[2-oxidanylidene-2-[4-(thiophen-3-ylmethyl)-1,4-diazepan-1-yl]ethyl]-4-phenyl-1,3-oxazolidin-2-one Openeye Name: 3-[2-oxo-2-[4-(3-thienylmethyl)-1,4-diazepan-1-yl]ethyl]-4-phenyl-oxazolidin-2-one CAS Name: 3-[2-oxo-2-[4-(3-thiophenylmethyl)-1,4-diazepan-1-yl]ethyl]-4-phenyl-2-oxazolidinone IUPAC Name: 3-[2-oxo-2-[4-(thiophen-3-ylmethyl)-1,4-diazepan-1-yl]ethyl]-4-phenyl-1,3-oxazolidin-2-one Traditional Name: 3-[2-keto-2-[4-(3-thenyl)-1,4-diazepan-1-yl]ethyl]-4-phenyl-oxazolidin-2-one Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)CN2C(COC2=O)C3=CC=CC=C3)CC4=CSC=C4

Isomeric SMILES

C1CN(CCN(C1)C(=O)CN2C(COC2=O)C3=CC=CC=C3)CC4=CSC=C4

InChI

InChI=1S/C21H25N3O3S/c25-20(14-24-19(15-27-21(24)26)18-5-2-1-3-6-18)23-9-4-8-22(10-11-23)13-17-7-12-28-16-17/h1-3,5-7,12,16,19H,4,8-11,13-15H2