N-[2-[(4-thiophen-2-ylcarbonylthieno[3,2-d]pyrimidin-2-yl)amino]ethyl]butane-1-sulfonamide

Systemtic Name: N-[2-[(4-thiophen-2-ylcarbonylthieno[3,2-d]pyrimidin-2-yl)amino]ethyl]butane-1-sulfonamide Openeye Name: N-[2-[[4-(thiophene-2-carbonyl)thieno[3,2-d]pyrimidin-2-yl]amino]ethyl]butane-1-sulfonamide CAS Name: N-[2-[[4-[oxo(thiophen-2-yl)methyl]-2-thieno[3,2-d]pyrimidinyl]amino]ethyl]-1-butanesulfonamide IUPAC Name: N-[2-[[4-(thiophene-2-carbonyl)thieno[3,2-d]pyrimidin-2-yl]amino]ethyl]butane-1-sulfonamide Traditional Name: N-[2-[[4-(2-thenoyl)thieno[3,2-d]pyrimidin-2-yl]amino]ethyl]butane-1-sulfonamide Formula: C17H20N4O3S3 MolecularWeight: 424.5607

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NCCNC1=NC2=C(C(=N1)C(=O)C3=CC=CS3)SC=C2

Isomeric SMILES

CCCCS(=O)(=O)NCCNC1=NC2=C(C(=N1)C(=O)C3=CC=CS3)SC=C2

InChI

InChI=1S/C17H20N4O3S3/c1-2-3-11-27(23,24)19-8-7-18-17-20-12-6-10-26-16(12)14(21-17)15(22)13-5-4-9-25-13/h4-6,9-10,19H,2-3,7-8,11H2,1H3,(H,18,20,21)