N-(6-methoxy-1,3-benzothiazol-2-yl)-3-(1-phenylpyrazol-4-yl)propanamide

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-3-(1-phenylpyrazol-4-yl)propanamide Openeye Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-3-(1-phenylpyrazol-4-yl)propanamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-3-(1-phenyl-4-pyrazolyl)propanamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-3-(1-phenylpyrazol-4-yl)propanamide Traditional Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-3-(1-phenylpyrazol-4-yl)propionamide Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)CCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)CCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C20H18N4O2S/c1-26-16-8-9-17-18(11-16)27-20(22-17)23-19(25)10-7-14-12-21-24(13-14)15-5-3-2-4-6-15/h2-6,8-9,11-13H,7,10H2,1H3,(H,22,23,25)