N2-(2-azanylethyl)-6-chloranyl-N7-(phenylmethyl)-4-pyrrolidin-1-yl-pteridine-2,7-diamine

Systemtic Name: N2-(2-azanylethyl)-6-chloranyl-N7-(phenylmethyl)-4-pyrrolidin-1-yl-pteridine-2,7-diamine Openeye Name: N2-(2-aminoethyl)-N7-benzyl-6-chloro-4-pyrrolidin-1-yl-pteridine-2,7-diamine CAS Name: N2-(2-aminoethyl)-6-chloro-N7-(phenylmethyl)-4-(1-pyrrolidinyl)pteridine-2,7-diamine IUPAC Name: 2-N-(2-aminoethyl)-7-N-benzyl-6-chloro-4-pyrrolidin-1-ylpteridine-2,7-diamine Traditional Name: 2-aminoethyl-[7-(benzylamino)-6-chloro-4-pyrrolidino-pteridin-2-yl]amine Formula: C19H23ClN8 MolecularWeight: 398.89252

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=NC3=C2N=C(C(=N3)NCC4=CC=CC=C4)Cl)NCCN

Isomeric SMILES

C1CCN(C1)C2=NC(=NC3=C2N=C(C(=N3)NCC4=CC=CC=C4)Cl)NCCN

InChI

InChI=1S/C19H23ClN8/c20-15-17(23-12-13-6-2-1-3-7-13)25-16-14(24-15)18(28-10-4-5-11-28)27-19(26-16)22-9-8-21/h1-3,6-7H,4-5,8-12,21H2,(H2,22,23,25,26,27)