2-[2-(4-cyclopropylcarbonylpiperazin-1-yl)carbonylphenyl]sulfanylbenzenecarbonitrile

Systemtic Name: 2-[2-(4-cyclopropylcarbonylpiperazin-1-yl)carbonylphenyl]sulfanylbenzenecarbonitrile Openeye Name: 2-[2-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]phenyl]sulfanylbenzonitrile CAS Name: 2-[[2-[[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]-oxomethyl]phenyl]thio]benzonitrile IUPAC Name: 2-[2-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]phenyl]sulfanylbenzonitrile Traditional Name: 2-[[2-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]phenyl]thio]benzonitrile Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3SC4=CC=CC=C4C#N

Isomeric SMILES

C1CC1C(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3SC4=CC=CC=C4C#N

InChI

InChI=1S/C22H21N3O2S/c23-15-17-5-1-3-7-19(17)28-20-8-4-2-6-18(20)22(27)25-13-11-24(12-14-25)21(26)16-9-10-16/h1-8,16H,9-14H2