3-methyl-N-[[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylphenyl]carbamothioyl]benzamide

Systemtic Name: 3-methyl-N-[[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylphenyl]carbamothioyl]benzamide Openeye Name: 3-methyl-N-[[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylphenyl]carbamothioyl]benzamide CAS Name: 3-methyl-N-[[2-[(5-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-methyl-N-[[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylphenyl]carbamothioyl]benzamide Traditional Name: 3-methyl-N-[[2-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)thio]phenyl]thiocarbamoyl]benzamide Formula: C27H20N4OS3 MolecularWeight: 512.6689

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2SC3=NC=NC4=C3C(=CS4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2SC3=NC=NC4=C3C(=CS4)C5=CC=CC=C5

InChI

InChI=1S/C27H20N4OS3/c1-17-8-7-11-19(14-17)24(32)31-27(33)30-21-12-5-6-13-22(21)35-26-23-20(18-9-3-2-4-10-18)15-34-25(23)28-16-29-26/h2-16H,1H3,(H2,30,31,32,33)