4-[2-(ethylcarbamoylamino)-1,3-benzothiazol-6-yl]-N-phenyl-pyrazole-1-carboxamide

Systemtic Name: 4-[2-(ethylcarbamoylamino)-1,3-benzothiazol-6-yl]-N-phenyl-pyrazole-1-carboxamide Openeye Name: 4-[2-(ethylcarbamoylamino)-1,3-benzothiazol-6-yl]-N-phenyl-pyrazole-1-carboxamide CAS Name: 4-[2-(ethylcarbamoylamino)-1,3-benzothiazol-6-yl]-N-phenyl-1-pyrazolecarboxamide IUPAC Name: 4-[2-(ethylcarbamoylamino)-1,3-benzothiazol-6-yl]-N-phenylpyrazole-1-carboxamide Traditional Name: 4-[2-(ethylcarbamoylamino)-1,3-benzothiazol-6-yl]-N-phenyl-pyrazole-1-carboxamide Formula: C20H18N6O2S MolecularWeight: 406.46092

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=NC2=C(S1)C=C(C=C2)C3=CN(N=C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CCNC(=O)NC1=NC2=C(S1)C=C(C=C2)C3=CN(N=C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C20H18N6O2S/c1-2-21-18(27)25-19-24-16-9-8-13(10-17(16)29-19)14-11-22-26(12-14)20(28)23-15-6-4-3-5-7-15/h3-12H,2H2,1H3,(H,23,28)(H2,21,24,25,27)