4-[(pyrimidin-2-ylamino)carbamoyl]-N-(2-thiophen-2-ylethyl)benzenesulfonamide

Systemtic Name: 4-[(pyrimidin-2-ylamino)carbamoyl]-N-(2-thiophen-2-ylethyl)benzenesulfonamide Openeye Name: 4-[(pyrimidin-2-ylamino)carbamoyl]-N-[2-(2-thienyl)ethyl]benzenesulfonamide CAS Name: 4-[oxo-(2-pyrimidinylhydrazo)methyl]-N-(2-thiophen-2-ylethyl)benzenesulfonamide IUPAC Name: 4-[(pyrimidin-2-ylamino)carbamoyl]-N-(2-thiophen-2-ylethyl)benzenesulfonamide Traditional Name: 4-[(2-pyrimidylamino)carbamoyl]-N-[2-(2-thienyl)ethyl]benzenesulfonamide Formula: C17H17N5O3S2 MolecularWeight: 403.47858

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NNC(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC3=CC=CS3

Isomeric SMILES

C1=CN=C(N=C1)NNC(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC3=CC=CS3

InChI

InChI=1S/C17H17N5O3S2/c23-16(21-22-17-18-9-2-10-19-17)13-4-6-15(7-5-13)27(24,25)20-11-8-14-3-1-12-26-14/h1-7,9-10,12,20H,8,11H2,(H,21,23)(H,18,19,22)