N-[4-[2-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]phenyl]thiophene-2-sulfonamide

Systemtic Name: N-[4-[2-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]phenyl]thiophene-2-sulfonamide Openeye Name: N-[4-[2-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]-2-oxo-ethyl]phenyl]thiophene-2-sulfonamide CAS Name: N-[4-[2-[4-(4-methoxy-2-pyrimidinyl)-1-piperazinyl]-2-oxoethyl]phenyl]-2-thiophenesulfonamide IUPAC Name: N-[4-[2-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]-2-oxoethyl]phenyl]thiophene-2-sulfonamide Traditional Name: N-[4-[2-keto-2-[4-(4-methoxypyrimidin-2-yl)piperazino]ethyl]phenyl]thiophene-2-sulfonamide Formula: C21H23N5O4S2 MolecularWeight: 473.56842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC=C1)N2CCN(CC2)C(=O)CC3=CC=C(C=C3)NS(=O)(=O)C4=CC=CS4

Isomeric SMILES

COC1=NC(=NC=C1)N2CCN(CC2)C(=O)CC3=CC=C(C=C3)NS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H23N5O4S2/c1-30-18-8-9-22-21(23-18)26-12-10-25(11-13-26)19(27)15-16-4-6-17(7-5-16)24-32(28,29)20-3-2-14-31-20/h2-9,14,24H,10-13,15H2,1H3