2-[(4-azanyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]-3-(3-oxidanylpropyl)quinazolin-4-one

Systemtic Name: 2-[(4-azanyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]-3-(3-oxidanylpropyl)quinazolin-4-one Openeye Name: 2-[(4-amino-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]-3-(3-hydroxypropyl)quinazolin-4-one CAS Name: 2-[(4-amino-5,6-dimethyl-2-thieno[2,3-d]pyrimidinyl)methylthio]-3-(3-hydroxypropyl)-4-quinazolinone IUPAC Name: 2-[(4-amino-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]-3-(3-hydroxypropyl)quinazolin-4-one Traditional Name: 2-[(4-amino-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)methylthio]-3-(3-hydroxypropyl)quinazolin-4-one Formula: C20H21N5O2S2 MolecularWeight: 427.54304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N)CSC3=NC4=CC=CC=C4C(=O)N3CCCO)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N)CSC3=NC4=CC=CC=C4C(=O)N3CCCO)C

InChI

InChI=1S/C20H21N5O2S2/c1-11-12(2)29-18-16(11)17(21)23-15(24-18)10-28-20-22-14-7-4-3-6-13(14)19(27)25(20)8-5-9-26/h3-4,6-7,26H,5,8-10H2,1-2H3,(H2,21,23,24)