2-[[4-(3-azanylpyrrolidin-1-yl)phenyl]amino]-8-cyclopentyl-pteridin-7-one

Systemtic Name: 2-[[4-(3-azanylpyrrolidin-1-yl)phenyl]amino]-8-cyclopentyl-pteridin-7-one Openeye Name: 2-[4-(3-aminopyrrolidin-1-yl)anilino]-8-cyclopentyl-pteridin-7-one CAS Name: 2-[4-(3-amino-1-pyrrolidinyl)anilino]-8-cyclopentyl-7-pteridinone IUPAC Name: 2-[4-(3-aminopyrrolidin-1-yl)anilino]-8-cyclopentylpteridin-7-one Traditional Name: 2-[4-(3-aminopyrrolidino)anilino]-8-cyclopentyl-pteridin-7-one Formula: C21H25N7O MolecularWeight: 391.4695

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=O)C=NC3=CN=C(N=C32)NC4=CC=C(C=C4)N5CCC(C5)N

Isomeric SMILES

C1CCC(C1)N2C(=O)C=NC3=CN=C(N=C32)NC4=CC=C(C=C4)N5CCC(C5)N

InChI

InChI=1S/C21H25N7O/c22-14-9-10-27(13-14)16-7-5-15(6-8-16)25-21-24-11-18-20(26-21)28(19(29)12-23-18)17-3-1-2-4-17/h5-8,11-12,14,17H,1-4,9-10,13,22H2,(H,24,25,26)