N3-ethyl-7-[(4-propan-2-ylphenyl)methyl]pyrrolo[3,2-f]quinazoline-1,3-diamine

Systemtic Name: N3-ethyl-7-[(4-propan-2-ylphenyl)methyl]pyrrolo[3,2-f]quinazoline-1,3-diamine Openeye Name: N3-ethyl-7-[(4-isopropylphenyl)methyl]pyrrolo[3,2-f]quinazoline-1,3-diamine CAS Name: N3-ethyl-7-[(4-propan-2-ylphenyl)methyl]pyrrolo[3,2-f]quinazoline-1,3-diamine IUPAC Name: 3-N-ethyl-7-[(4-propan-2-ylphenyl)methyl]pyrrolo[3,2-f]quinazoline-1,3-diamine Traditional Name: [1-amino-7-(4-isopropylbenzyl)pyrrolo[3,2-f]quinazolin-3-yl]-ethyl-amine Formula: C22H25N5 MolecularWeight: 359.4674

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC2=C(C3=C(C=C2)N(C=C3)CC4=CC=C(C=C4)C(C)C)C(=N1)N

Isomeric SMILES

CCNC1=NC2=C(C3=C(C=C2)N(C=C3)CC4=CC=C(C=C4)C(C)C)C(=N1)N

InChI

InChI=1S/C22H25N5/c1-4-24-22-25-18-9-10-19-17(20(18)21(23)26-22)11-12-27(19)13-15-5-7-16(8-6-15)14(2)3/h5-12,14H,4,13H2,1-3H3,(H3,23,24,25,26)