N-[4-[2-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]pyrazine-2-carboxamide

Systemtic Name: N-[4-[2-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]pyrazine-2-carboxamide Openeye Name: N-[4-[2-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]thiazol-2-yl]pyrazine-2-carboxamide CAS Name: N-[4-[2-[4-(3-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]-2-thiazolyl]-2-pyrazinecarboxamide IUPAC Name: N-[4-[2-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]-1,3-thiazol-2-yl]pyrazine-2-carboxamide Traditional Name: N-[4-[2-keto-2-[4-(3-methoxyphenyl)piperazino]ethyl]thiazol-2-yl]pyrazinamide Formula: C21H22N6O3S MolecularWeight: 438.50278

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)CC3=CSC(=N3)NC(=O)C4=NC=CN=C4

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)CC3=CSC(=N3)NC(=O)C4=NC=CN=C4

InChI

InChI=1S/C21H22N6O3S/c1-30-17-4-2-3-16(12-17)26-7-9-27(10-8-26)19(28)11-15-14-31-21(24-15)25-20(29)18-13-22-5-6-23-18/h2-6,12-14H,7-11H2,1H3,(H,24,25,29)