1-(2-aminophenyl)-3-azanyl-3-(3-azanylpropyl)-5-thiophen-3-yl-pentane-2,4-dione

Systemtic Name: 1-(2-aminophenyl)-3-azanyl-3-(3-azanylpropyl)-5-thiophen-3-yl-pentane-2,4-dione Openeye Name: 3-amino-1-(2-aminophenyl)-3-(3-aminopropyl)-5-(3-thienyl)pentane-2,4-dione CAS Name: 3-amino-1-(2-aminophenyl)-3-(3-aminopropyl)-5-(3-thiophenyl)pentane-2,4-dione IUPAC Name: 3-amino-1-(2-aminophenyl)-3-(3-aminopropyl)-5-thiophen-3-ylpentane-2,4-dione Traditional Name: 3-amino-1-(2-aminophenyl)-3-(3-aminopropyl)-5-(3-thienyl)pentane-2,4-dione Formula: C18H23N3O2S MolecularWeight: 345.45912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC(=O)C(CCCN)(C(=O)CC2=CSC=C2)N)N

Isomeric SMILES

C1=CC=C(C(=C1)CC(=O)C(CCCN)(C(=O)CC2=CSC=C2)N)N

InChI

InChI=1S/C18H23N3O2S/c19-8-3-7-18(21,16(22)10-13-6-9-24-12-13)17(23)11-14-4-1-2-5-15(14)20/h1-2,4-6,9,12H,3,7-8,10-11,19-21H2