4-(4-butylphenyl)-N-(3-methoxyquinoxalin-2-yl)piperazine-1-carbothioamide

Systemtic Name: 4-(4-butylphenyl)-N-(3-methoxyquinoxalin-2-yl)piperazine-1-carbothioamide Openeye Name: 4-(4-butylphenyl)-N-(3-methoxyquinoxalin-2-yl)piperazine-1-carbothioamide CAS Name: 4-(4-butylphenyl)-N-(3-methoxy-2-quinoxalinyl)-1-piperazinecarbothioamide IUPAC Name: 4-(4-butylphenyl)-N-(3-methoxyquinoxalin-2-yl)piperazine-1-carbothioamide Traditional Name: 4-(4-butylphenyl)-N-(3-methoxyquinoxalin-2-yl)piperazine-1-carbothioamide Formula: C24H29N5OS MolecularWeight: 435.58496

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2CCN(CC2)C(=S)NC3=NC4=CC=CC=C4N=C3OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2CCN(CC2)C(=S)NC3=NC4=CC=CC=C4N=C3OC

InChI

InChI=1S/C24H29N5OS/c1-3-4-7-18-10-12-19(13-11-18)28-14-16-29(17-15-28)24(31)27-22-23(30-2)26-21-9-6-5-8-20(21)25-22/h5-6,8-13H,3-4,7,14-17H2,1-2H3,(H,25,27,31)