methyl 4-[[3-(1,3-benzothiazol-2-yl)pyrazin-2-yl]carbonylamino]butanoate

Systemtic Name: methyl 4-[[3-(1,3-benzothiazol-2-yl)pyrazin-2-yl]carbonylamino]butanoate Openeye Name: methyl 4-[[3-(1,3-benzothiazol-2-yl)pyrazine-2-carbonyl]amino]butanoate CAS Name: 4-[[[3-(1,3-benzothiazol-2-yl)-2-pyrazinyl]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[3-(1,3-benzothiazol-2-yl)pyrazine-2-carbonyl]amino]butanoate Traditional Name: 4-[[3-(1,3-benzothiazol-2-yl)pyrazinoyl]amino]butyric acid methyl ester Formula: C17H16N4O3S MolecularWeight: 356.39894

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)C1=NC=CN=C1C2=NC3=CC=CC=C3S2

Isomeric SMILES

COC(=O)CCCNC(=O)C1=NC=CN=C1C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H16N4O3S/c1-24-13(22)7-4-8-20-16(23)14-15(19-10-9-18-14)17-21-11-5-2-3-6-12(11)25-17/h2-3,5-6,9-10H,4,7-8H2,1H3,(H,20,23)