2-(4-azanyl-5-thiophen-2-ylsulfonyl-pyrimidin-2-yl)sulfanyl-N-(4-methoxyphenyl)ethanamide

Systemtic Name: 2-(4-azanyl-5-thiophen-2-ylsulfonyl-pyrimidin-2-yl)sulfanyl-N-(4-methoxyphenyl)ethanamide Openeye Name: 2-[4-amino-5-(2-thienylsulfonyl)pyrimidin-2-yl]sulfanyl-N-(4-methoxyphenyl)acetamide CAS Name: 2-[(4-amino-5-thiophen-2-ylsulfonyl-2-pyrimidinyl)thio]-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-(4-amino-5-thiophen-2-ylsulfonylpyrimidin-2-yl)sulfanyl-N-(4-methoxyphenyl)acetamide Traditional Name: 2-[[4-amino-5-(2-thienylsulfonyl)pyrimidin-2-yl]thio]-N-(4-methoxyphenyl)acetamide Formula: C17H16N4O4S3 MolecularWeight: 436.52834

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CSC2=NC=C(C(=N2)N)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CSC2=NC=C(C(=N2)N)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C17H16N4O4S3/c1-25-12-6-4-11(5-7-12)20-14(22)10-27-17-19-9-13(16(18)21-17)28(23,24)15-3-2-8-26-15/h2-9H,10H2,1H3,(H,20,22)(H2,18,19,21)