2-ethyl-4-(4-methylpiperazin-1-yl)carbonyl-3-phenyl-1-benzofuran-5-carbonitrile

Systemtic Name: 2-ethyl-4-(4-methylpiperazin-1-yl)carbonyl-3-phenyl-1-benzofuran-5-carbonitrile Openeye Name: 2-ethyl-4-(4-methylpiperazine-1-carbonyl)-3-phenyl-benzofuran-5-carbonitrile CAS Name: 2-ethyl-4-[(4-methyl-1-piperazinyl)-oxomethyl]-3-phenyl-5-benzofurancarbonitrile IUPAC Name: 2-ethyl-4-(4-methylpiperazine-1-carbonyl)-3-phenyl-1-benzofuran-5-carbonitrile Traditional Name: 2-ethyl-4-(4-methylpiperazine-1-carbonyl)-3-phenyl-benzofuran-5-carbonitrile Formula: C23H23N3O2 MolecularWeight: 373.44762

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(O1)C=CC(=C2C(=O)N3CCN(CC3)C)C#N)C4=CC=CC=C4

Isomeric SMILES

CCC1=C(C2=C(O1)C=CC(=C2C(=O)N3CCN(CC3)C)C#N)C4=CC=CC=C4

InChI

InChI=1S/C23H23N3O2/c1-3-18-20(16-7-5-4-6-8-16)22-19(28-18)10-9-17(15-24)21(22)23(27)26-13-11-25(2)12-14-26/h4-10H,3,11-14H2,1-2H3