3-(cyclopropylmethyl)-N-ethyl-8-propan-2-yl-purin-6-amine; 3-ethyl-N-(phenylmethyl)-8-propan-2-yl-purin-6-amine

Systemtic Name: 3-(cyclopropylmethyl)-N-ethyl-8-propan-2-yl-purin-6-amine; 3-ethyl-N-(phenylmethyl)-8-propan-2-yl-purin-6-amine Openeye Name: N-benzyl-3-ethyl-8-isopropyl-purin-6-amine; 3-(cyclopropylmethyl)-N-ethyl-8-isopropyl-purin-6-amine CAS Name: 3-(cyclopropylmethyl)-N-ethyl-8-propan-2-yl-6-purinamine; 3-ethyl-N-(phenylmethyl)-8-propan-2-yl-6-purinamine IUPAC Name: N-benzyl-3-ethyl-8-propan-2-ylpurin-6-amine; 3-(cyclopropylmethyl)-N-ethyl-8-propan-2-ylpurin-6-amine Traditional Name: benzyl-(3-ethyl-8-isopropyl-purin-6-yl)amine; [3-(cyclopropylmethyl)-8-isopropyl-purin-6-yl]-ethyl-amine Formula: C31H42N10 MolecularWeight: 554.73218

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C2C(=NC(=N2)C(C)C)N(C=N1)CC3CC3.CCN1C=NC(=C2C1=NC(=N2)C(C)C)NCC3=CC=CC=C3

Isomeric SMILES

CCNC1=C2C(=NC(=N2)C(C)C)N(C=N1)CC3CC3.CCN1C=NC(=C2C1=NC(=N2)C(C)C)NCC3=CC=CC=C3

InChI

InChI=1S/C17H21N5.C14H21N5/c1-4-22-11-19-16(18-10-13-8-6-5-7-9-13)14-17(22)21-15(20-14)12(2)3;1-4-15-13-11-14(18-12(17-11)9(2)3)19(8-16-13)7-10-5-6-10/h5-9,11-12,18H,4,10H2,1-3H3;8-10,15H,4-7H2,1-3H3