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

Systemtic Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-[(4-phenylphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide Formula: C31H24N4O2S MolecularWeight: 516.61286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=NN(C=C4)COC5=CC=C(C=C5)C6=CC=CC=C6

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=NN(C=C4)COC5=CC=C(C=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H24N4O2S/c1-21-7-16-27-29(19-21)38-31(33-27)24-8-12-25(13-9-24)32-30(36)28-17-18-35(34-28)20-37-26-14-10-23(11-15-26)22-5-3-2-4-6-22/h2-19H,20H2,1H3,(H,32,36)