N-(2,7-dimethyl-2-propyl-chromen-6-yl)-4-phenyl-piperazine-1-carbothioamide

Systemtic Name: N-(2,7-dimethyl-2-propyl-chromen-6-yl)-4-phenyl-piperazine-1-carbothioamide Openeye Name: N-(2,7-dimethyl-2-propyl-chromen-6-yl)-4-phenyl-piperazine-1-carbothioamide CAS Name: N-(2,7-dimethyl-2-propyl-1-benzopyran-6-yl)-4-phenyl-1-piperazinecarbothioamide IUPAC Name: N-(2,7-dimethyl-2-propylchromen-6-yl)-4-phenylpiperazine-1-carbothioamide Traditional Name: N-(2,7-dimethyl-2-propyl-chromen-6-yl)-4-phenyl-piperazine-1-carbothioamide Formula: C25H31N3OS MolecularWeight: 421.59814

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C=CC2=CC(=C(C=C2O1)C)NC(=S)N3CCN(CC3)C4=CC=CC=C4)C

Isomeric SMILES

CCCC1(C=CC2=CC(=C(C=C2O1)C)NC(=S)N3CCN(CC3)C4=CC=CC=C4)C

InChI

InChI=1S/C25H31N3OS/c1-4-11-25(3)12-10-20-18-22(19(2)17-23(20)29-25)26-24(30)28-15-13-27(14-16-28)21-8-6-5-7-9-21/h5-10,12,17-18H,4,11,13-16H2,1-3H3,(H,26,30)