3-[4-[4-(4-oxidanyl-1,3-thiazol-2-yl)piperazin-1-yl]butyl]-1H-indole-5-carbonitrile

Systemtic Name: 3-[4-[4-(4-oxidanyl-1,3-thiazol-2-yl)piperazin-1-yl]butyl]-1H-indole-5-carbonitrile Openeye Name: 3-[4-[4-(4-hydroxythiazol-2-yl)piperazin-1-yl]butyl]-1H-indole-5-carbonitrile CAS Name: 3-[4-[4-(4-hydroxy-2-thiazolyl)-1-piperazinyl]butyl]-1H-indole-5-carbonitrile IUPAC Name: 3-[4-[4-(4-hydroxy-1,3-thiazol-2-yl)piperazin-1-yl]butyl]-1H-indole-5-carbonitrile Traditional Name: 3-[4-[4-(4-hydroxythiazol-2-yl)piperazino]butyl]-1H-indole-5-carbonitrile Formula: C20H23N5OS MolecularWeight: 381.49452

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCC2=CNC3=C2C=C(C=C3)C#N)C4=NC(=CS4)O

Isomeric SMILES

C1CN(CCN1CCCCC2=CNC3=C2C=C(C=C3)C#N)C4=NC(=CS4)O

InChI

InChI=1S/C20H23N5OS/c21-12-15-4-5-18-17(11-15)16(13-22-18)3-1-2-6-24-7-9-25(10-8-24)20-23-19(26)14-27-20/h4-5,11,13-14,22,26H,1-3,6-10H2