7-pentan-3-ylpyrrolo[3,2-f]quinazoline-1,3-diamine hydrate

Systemtic Name: 7-pentan-3-ylpyrrolo[3,2-f]quinazoline-1,3-diamine hydrate Openeye Name: 7-(1-ethylpropyl)pyrrolo[3,2-f]quinazoline-1,3-diamine hydrate CAS Name: 7-pentan-3-ylpyrrolo[3,2-f]quinazoline-1,3-diamine hydrate IUPAC Name: 7-pentan-3-ylpyrrolo[3,2-f]quinazoline-1,3-diamine hydrate Traditional Name: [1-amino-7-(1-ethylpropyl)pyrrolo[3,2-f]quinazolin-3-yl]amine hydrate Formula: C15H21N5O MolecularWeight: 287.36014

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1C=CC2=C1C=CC3=C2C(=NC(=N3)N)N.O

Isomeric SMILES

CCC(CC)N1C=CC2=C1C=CC3=C2C(=NC(=N3)N)N.O

InChI

InChI=1S/C15H19N5.H2O/c1-3-9(4-2)20-8-7-10-12(20)6-5-11-13(10)14(16)19-15(17)18-11;/h5-9H,3-4H2,1-2H3,(H4,16,17,18,19);1H2