6-azanyl-1-butyl-5-[furan-2-ylmethyl-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]amino]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-1-butyl-5-[furan-2-ylmethyl-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]amino]pyrimidine-2,4-dione Openeye Name: 6-amino-1-butyl-5-[2-furylmethyl-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]amino]pyrimidine-2,4-dione CAS Name: 6-amino-1-butyl-5-[2-furanylmethyl-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]amino]pyrimidine-2,4-dione IUPAC Name: 6-amino-1-butyl-5-[furan-2-ylmethyl-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]amino]pyrimidine-2,4-dione Traditional Name: 6-amino-1-butyl-5-[2-furfuryl-[(4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]amino]pyrimidine-2,4-quinone Formula: C20H22N6O4S MolecularWeight: 442.49148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CO2)CC3=NC(=O)C4=C(N3)C=CS4)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CO2)CC3=NC(=O)C4=C(N3)C=CS4)N

InChI

InChI=1S/C20H22N6O4S/c1-2-3-7-26-17(21)15(18(27)24-20(26)29)25(10-12-5-4-8-30-12)11-14-22-13-6-9-31-16(13)19(28)23-14/h4-6,8-9H,2-3,7,10-11,21H2,1H3,(H,22,23,28)(H,24,27,29)