(E)-2-[(2-methyl-1H-indol-3-yl)carbonyl]-3-[1-(phenylmethyl)pyrazol-4-yl]prop-2-enenitrile

Systemtic Name: (E)-2-[(2-methyl-1H-indol-3-yl)carbonyl]-3-[1-(phenylmethyl)pyrazol-4-yl]prop-2-enenitrile Openeye Name: (E)-3-(1-benzylpyrazol-4-yl)-2-(2-methyl-1H-indole-3-carbonyl)prop-2-enenitrile CAS Name: (E)-2-[(2-methyl-1H-indol-3-yl)-oxomethyl]-3-[1-(phenylmethyl)-4-pyrazolyl]-2-propenenitrile IUPAC Name: (E)-3-(1-benzylpyrazol-4-yl)-2-(2-methyl-1H-indole-3-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-(1-benzylpyrazol-4-yl)-2-(2-methyl-1H-indole-3-carbonyl)acrylonitrile Formula: C23H18N4O MolecularWeight: 366.41522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C(=CC3=CN(N=C3)CC4=CC=CC=C4)C#N

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)/C(=C/C3=CN(N=C3)CC4=CC=CC=C4)/C#N

InChI

InChI=1S/C23H18N4O/c1-16-22(20-9-5-6-10-21(20)26-16)23(28)19(12-24)11-18-13-25-27(15-18)14-17-7-3-2-4-8-17/h2-11,13,15,26H,14H2,1H3/b19-11+