N-(3,4-dimethoxyphenyl)-4-propyl-piperazine-1-carbothioamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-4-propyl-piperazine-1-carbothioamide Openeye Name: N-(3,4-dimethoxyphenyl)-4-propyl-piperazine-1-carbothioamide CAS Name: N-(3,4-dimethoxyphenyl)-4-propyl-1-piperazinecarbothioamide IUPAC Name: N-(3,4-dimethoxyphenyl)-4-propylpiperazine-1-carbothioamide Traditional Name: N-(3,4-dimethoxyphenyl)-4-propyl-piperazine-1-carbothioamide Formula: C16H25N3O2S MolecularWeight: 323.4536

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C(=S)NC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCCN1CCN(CC1)C(=S)NC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C16H25N3O2S/c1-4-7-18-8-10-19(11-9-18)16(22)17-13-5-6-14(20-2)15(12-13)21-3/h5-6,12H,4,7-11H2,1-3H3,(H,17,22)