2-[bis(2-hydroxyethyl)amino]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[bis(2-hydroxyethyl)amino]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 2-[bis(2-hydroxyethyl)amino]-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 2-[bis(2-hydroxyethyl)amino]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 2-[bis(2-hydroxyethyl)amino]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 2-[bis(2-hydroxyethyl)amino]-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one Formula: C14H19N3O3S MolecularWeight: 309.38396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(S2)N=C(NC3=O)N(CCO)CCO

Isomeric SMILES

C1CCC2=C(C1)C3=C(S2)N=C(NC3=O)N(CCO)CCO

InChI

InChI=1S/C14H19N3O3S/c18-7-5-17(6-8-19)14-15-12(20)11-9-3-1-2-4-10(9)21-13(11)16-14/h18-19H,1-8H2,(H,15,16,20)