2-[(3-morpholin-4-ylsulfonylphenyl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 2-[(3-morpholin-4-ylsulfonylphenyl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine Openeye Name: 2-[(3-morpholinosulfonylphenyl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine CAS Name: 2-[[3-(4-morpholinylsulfonyl)phenyl]methylthio]-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 2-[(3-morpholin-4-ylsulfonylphenyl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine Traditional Name: [2-[(3-morpholinosulfonylbenzyl)thio]thieno[2,3-d]pyrimidin-4-yl]amine Formula: C17H18N4O3S3 MolecularWeight: 422.54482

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)CSC3=NC(=C4C=CSC4=N3)N

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)CSC3=NC(=C4C=CSC4=N3)N

InChI

InChI=1S/C17H18N4O3S3/c18-15-14-4-9-25-16(14)20-17(19-15)26-11-12-2-1-3-13(10-12)27(22,23)21-5-7-24-8-6-21/h1-4,9-10H,5-8,11H2,(H2,18,19,20)