2-methyl-N-(3-morpholin-4-ylcarbothioyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzenecarbothioamide

Systemtic Name: 2-methyl-N-(3-morpholin-4-ylcarbothioyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzenecarbothioamide Openeye Name: 2-methyl-N-[3-(morpholine-4-carbothioyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]benzenecarbothioamide CAS Name: 2-methyl-N-[3-[4-morpholinyl(sulfanylidene)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzenecarbothioamide IUPAC Name: 2-methyl-N-[3-(morpholine-4-carbothioyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzenecarbothioamide Traditional Name: 2-methyl-N-[3-(morpholine-4-carbothioyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]thiobenzamide Formula: C21H24N2OS3 MolecularWeight: 416.62306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=S)NC2=C(C3=C(S2)CCCC3)C(=S)N4CCOCC4

Isomeric SMILES

CC1=CC=CC=C1C(=S)NC2=C(C3=C(S2)CCCC3)C(=S)N4CCOCC4

InChI

InChI=1S/C21H24N2OS3/c1-14-6-2-3-7-15(14)19(25)22-20-18(16-8-4-5-9-17(16)27-20)21(26)23-10-12-24-13-11-23/h2-3,6-7H,4-5,8-13H2,1H3,(H,22,25)