5-nitro-6-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]quinoline

Systemtic Name: 5-nitro-6-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]quinoline Openeye Name: 5-nitro-6-[4-(2-thienylmethyl)-1,4-diazepan-1-yl]quinoline CAS Name: 5-nitro-6-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]quinoline IUPAC Name: 5-nitro-6-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]quinoline Traditional Name: 5-nitro-6-[4-(2-thenyl)-1,4-diazepan-1-yl]quinoline Formula: C19H20N4O2S MolecularWeight: 368.4527

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C2=C(C3=C(C=C2)N=CC=C3)[N+](=O)[O-])CC4=CC=CS4

Isomeric SMILES

C1CN(CCN(C1)C2=C(C3=C(C=C2)N=CC=C3)[N+](=O)[O-])CC4=CC=CS4

InChI

InChI=1S/C19H20N4O2S/c24-23(25)19-16-5-1-8-20-17(16)6-7-18(19)22-10-3-9-21(11-12-22)14-15-4-2-13-26-15/h1-2,4-8,13H,3,9-12,14H2