N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]-3-propoxy-benzamide

Systemtic Name: N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]-3-propoxy-benzamide Openeye Name: N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]-3-propoxy-benzamide CAS Name: N-[[4-[(4-methyl-1-piperazinyl)sulfonyl]anilino]-sulfanylidenemethyl]-3-propoxybenzamide IUPAC Name: N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]-3-propoxybenzamide Traditional Name: N-[[4-(4-methylpiperazino)sulfonylphenyl]thiocarbamoyl]-3-propoxy-benzamide Formula: C22H28N4O4S2 MolecularWeight: 476.61212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C

InChI

InChI=1S/C22H28N4O4S2/c1-3-15-30-19-6-4-5-17(16-19)21(27)24-22(31)23-18-7-9-20(10-8-18)32(28,29)26-13-11-25(2)12-14-26/h4-10,16H,3,11-15H2,1-2H3,(H2,23,24,27,31)