4-[[1,1-bis(oxidanylidene)thiolan-3-yl]methylamino]-N-butyl-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 4-[[1,1-bis(oxidanylidene)thiolan-3-yl]methylamino]-N-butyl-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-butyl-4-[(1,1-dioxothiolan-3-yl)methylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-butyl-4-[(1,1-dioxo-3-thiolanyl)methylamino]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-butyl-4-[(1,1-dioxothiolan-3-yl)methylamino]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-butyl-4-[(1,1-diketothiolan-3-yl)methylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C17H24N4O3S2 MolecularWeight: 396.52746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(C2=C(N=CN=C2S1)NCC3CCS(=O)(=O)C3)C

Isomeric SMILES

CCCCNC(=O)C1=C(C2=C(N=CN=C2S1)NCC3CCS(=O)(=O)C3)C

InChI

InChI=1S/C17H24N4O3S2/c1-3-4-6-18-16(22)14-11(2)13-15(20-10-21-17(13)25-14)19-8-12-5-7-26(23,24)9-12/h10,12H,3-9H2,1-2H3,(H,18,22)(H,19,20,21)