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

Systemtic Name: 6-azanyl-1-butyl-5-[ethyl-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]amino]pyrimidine-2,4-dione Openeye Name: 6-amino-1-butyl-5-[ethyl-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]amino]pyrimidine-2,4-dione CAS Name: 6-amino-1-butyl-5-[ethyl-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]amino]pyrimidine-2,4-dione IUPAC Name: 6-amino-1-butyl-5-[ethyl-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]amino]pyrimidine-2,4-dione Traditional Name: 6-amino-1-butyl-5-[ethyl-[(4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]amino]pyrimidine-2,4-quinone Formula: C17H22N6O3S MolecularWeight: 390.45998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC)CC2=NC(=O)C3=C(N2)C=CS3)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC)CC2=NC(=O)C3=C(N2)C=CS3)N

InChI

InChI=1S/C17H22N6O3S/c1-3-5-7-23-14(18)12(15(24)21-17(23)26)22(4-2)9-11-19-10-6-8-27-13(10)16(25)20-11/h6,8H,3-5,7,9,18H2,1-2H3,(H,19,20,25)(H,21,24,26)