4-(5,6-dimethyl-2-phenethyl-thieno[2,3-d]pyrimidin-4-yl)-N-propyl-piperazine-1-carbothioamide

Systemtic Name: 4-(5,6-dimethyl-2-phenethyl-thieno[2,3-d]pyrimidin-4-yl)-N-propyl-piperazine-1-carbothioamide Openeye Name: 4-(5,6-dimethyl-2-phenethyl-thieno[2,3-d]pyrimidin-4-yl)-N-propyl-piperazine-1-carbothioamide CAS Name: 4-(5,6-dimethyl-2-phenethyl-4-thieno[2,3-d]pyrimidinyl)-N-propyl-1-piperazinecarbothioamide IUPAC Name: 4-(5,6-dimethyl-2-phenethylthieno[2,3-d]pyrimidin-4-yl)-N-propylpiperazine-1-carbothioamide Traditional Name: 4-(5,6-dimethyl-2-phenethyl-thieno[2,3-d]pyrimidin-4-yl)-N-propyl-piperazine-1-carbothioamide Formula: C24H31N5S2 MolecularWeight: 453.66644

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)N1CCN(CC1)C2=C3C(=C(SC3=NC(=N2)CCC4=CC=CC=C4)C)C

Isomeric SMILES

CCCNC(=S)N1CCN(CC1)C2=C3C(=C(SC3=NC(=N2)CCC4=CC=CC=C4)C)C

InChI

InChI=1S/C24H31N5S2/c1-4-12-25-24(30)29-15-13-28(14-16-29)22-21-17(2)18(3)31-23(21)27-20(26-22)11-10-19-8-6-5-7-9-19/h5-9H,4,10-16H2,1-3H3,(H,25,30)