3-[4-(3-phenyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]carbonyl-4-propan-2-yloxy-benzenecarbonitrile

Systemtic Name: 3-[4-(3-phenyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]carbonyl-4-propan-2-yloxy-benzenecarbonitrile Openeye Name: 4-isopropoxy-3-[4-(3-phenyl-1,2,4-thiadiazol-5-yl)piperazine-1-carbonyl]benzonitrile CAS Name: 3-[oxo-[4-(3-phenyl-1,2,4-thiadiazol-5-yl)-1-piperazinyl]methyl]-4-propan-2-yloxybenzonitrile IUPAC Name: 3-[4-(3-phenyl-1,2,4-thiadiazol-5-yl)piperazine-1-carbonyl]-4-propan-2-yloxybenzonitrile Traditional Name: 4-isopropoxy-3-[4-(3-phenyl-1,2,4-thiadiazol-5-yl)piperazine-1-carbonyl]benzonitrile Formula: C23H23N5O2S MolecularWeight: 433.52602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C#N)C(=O)N2CCN(CC2)C3=NC(=NS3)C4=CC=CC=C4

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C#N)C(=O)N2CCN(CC2)C3=NC(=NS3)C4=CC=CC=C4

InChI

InChI=1S/C23H23N5O2S/c1-16(2)30-20-9-8-17(15-24)14-19(20)22(29)27-10-12-28(13-11-27)23-25-21(26-31-23)18-6-4-3-5-7-18/h3-9,14,16H,10-13H2,1-2H3