N-[bis(phenylmethyl)carbamothioyl]-4-methyl-6-phenyl-thieno[2,3-b]pyrrole-2-carboxamide

Systemtic Name: N-[bis(phenylmethyl)carbamothioyl]-4-methyl-6-phenyl-thieno[2,3-b]pyrrole-2-carboxamide Openeye Name: N-(dibenzylcarbamothioyl)-4-methyl-6-phenyl-thieno[2,3-b]pyrrole-2-carboxamide CAS Name: N-[[bis(phenylmethyl)amino]-sulfanylidenemethyl]-4-methyl-6-phenyl-2-thieno[2,3-b]pyrrolecarboxamide IUPAC Name: N-(dibenzylcarbamothioyl)-4-methyl-6-phenylthieno[2,3-b]pyrrole-2-carboxamide Traditional Name: N-(dibenzylthiocarbamoyl)-4-methyl-6-phenyl-thieno[2,3-b]pyrrole-2-carboxamide Formula: C29H25N3OS2 MolecularWeight: 495.6583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C2=C1C=C(S2)C(=O)NC(=S)N(CC3=CC=CC=C3)CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CN(C2=C1C=C(S2)C(=O)NC(=S)N(CC3=CC=CC=C3)CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H25N3OS2/c1-21-18-32(24-15-9-4-10-16-24)28-25(21)17-26(35-28)27(33)30-29(34)31(19-22-11-5-2-6-12-22)20-23-13-7-3-8-14-23/h2-18H,19-20H2,1H3,(H,30,33,34)