2-[4-[(E)-3-(5-methylthiophen-2-yl)prop-2-enoyl]piperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-[(E)-3-(5-methylthiophen-2-yl)prop-2-enoyl]piperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-[(E)-3-(5-methyl-2-thienyl)prop-2-enoyl]piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-[(E)-3-(5-methyl-2-thiophenyl)-1-oxoprop-2-enyl]-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-[(E)-3-(5-methylthiophen-2-yl)prop-2-enoyl]piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-[(E)-3-(5-methyl-2-thienyl)acryloyl]piperazino]isonicotinonitrile Formula: C18H18N4OS MolecularWeight: 338.42672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C=CC(=O)N2CCN(CC2)C3=NC=CC(=C3)C#N

Isomeric SMILES

CC1=CC=C(S1)/C=C/C(=O)N2CCN(CC2)C3=NC=CC(=C3)C#N

InChI

InChI=1S/C18H18N4OS/c1-14-2-3-16(24-14)4-5-18(23)22-10-8-21(9-11-22)17-12-15(13-19)6-7-20-17/h2-7,12H,8-11H2,1H3/b5-4+