[[9-(thiophen-2-ylmethyl)purin-8-yl]amino] N-(1-piperidin-1-ylethyl)carbamate

Systemtic Name: [[9-(thiophen-2-ylmethyl)purin-8-yl]amino] N-(1-piperidin-1-ylethyl)carbamate Openeye Name: [[9-(2-thienylmethyl)purin-8-yl]amino] N-[1-(1-piperidyl)ethyl]carbamate CAS Name: N-[1-(1-piperidinyl)ethyl]carbamic acid [[9-(thiophen-2-ylmethyl)-8-purinyl]amino] ester IUPAC Name: [[9-(thiophen-2-ylmethyl)purin-8-yl]amino] N-(1-piperidin-1-ylethyl)carbamate Traditional Name: N-(1-piperidinoethyl)carbamic acid [[9-(2-thenyl)purin-8-yl]amino] ester Formula: C18H23N7O2S MolecularWeight: 401.48592

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Descriptors Computed from Structure

Canonical SMILES:

CC(NC(=O)ONC1=NC2=CN=CN=C2N1CC3=CC=CS3)N4CCCCC4

Isomeric SMILES

CC(NC(=O)ONC1=NC2=CN=CN=C2N1CC3=CC=CS3)N4CCCCC4

InChI

InChI=1S/C18H23N7O2S/c1-13(24-7-3-2-4-8-24)21-18(26)27-23-17-22-15-10-19-12-20-16(15)25(17)11-14-6-5-9-28-14/h5-6,9-10,12-13H,2-4,7-8,11H2,1H3,(H,21,26)(H,22,23)