(3S)-3-methyl-4-(4-methylphenyl)-N-(4-morpholin-4-ylsulfonylphenyl)piperazine-1-carbothioamide

Systemtic Name: (3S)-3-methyl-4-(4-methylphenyl)-N-(4-morpholin-4-ylsulfonylphenyl)piperazine-1-carbothioamide Openeye Name: (3S)-3-methyl-N-(4-morpholinosulfonylphenyl)-4-(p-tolyl)piperazine-1-carbothioamide CAS Name: (3S)-3-methyl-4-(4-methylphenyl)-N-[4-(4-morpholinylsulfonyl)phenyl]-1-piperazinecarbothioamide IUPAC Name: (3S)-3-methyl-4-(4-methylphenyl)-N-(4-morpholin-4-ylsulfonylphenyl)piperazine-1-carbothioamide Traditional Name: (3S)-3-methyl-N-(4-morpholinosulfonylphenyl)-4-(p-tolyl)piperazine-1-carbothioamide Formula: C23H30N4O3S2 MolecularWeight: 474.6393

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=C(C=C2)C)C(=S)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C[C@H]1CN(CCN1C2=CC=C(C=C2)C)C(=S)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C23H30N4O3S2/c1-18-3-7-21(8-4-18)27-12-11-25(17-19(27)2)23(31)24-20-5-9-22(10-6-20)32(28,29)26-13-15-30-16-14-26/h3-10,19H,11-17H2,1-2H3,(H,24,31)/t19-/m0/s1