4-(5-bromanyl-3,4-dimethyl-thieno[2,3-b]thiophen-2-yl)-2-(phenylmethylsulfanyl)pyrimidine

Systemtic Name: 4-(5-bromanyl-3,4-dimethyl-thieno[2,3-b]thiophen-2-yl)-2-(phenylmethylsulfanyl)pyrimidine Openeye Name: 2-benzylsulfanyl-4-(5-bromo-3,4-dimethyl-thieno[2,3-b]thiophen-2-yl)pyrimidine CAS Name: 4-(5-bromo-3,4-dimethyl-2-thieno[2,3-b]thiophenyl)-2-(phenylmethylthio)pyrimidine IUPAC Name: 2-benzylsulfanyl-4-(5-bromo-3,4-dimethylthieno[2,3-b]thiophen-2-yl)pyrimidine Traditional Name: 2-(benzylthio)-4-(5-bromo-3,4-dimethyl-thieno[2,3-b]thiophen-2-yl)pyrimidine Formula: C19H15BrN2S3 MolecularWeight: 447.4348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=C(S2)Br)C)C3=NC(=NC=C3)SCC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=C1C(=C(S2)Br)C)C3=NC(=NC=C3)SCC4=CC=CC=C4

InChI

InChI=1S/C19H15BrN2S3/c1-11-15-12(2)17(20)25-18(15)24-16(11)14-8-9-21-19(22-14)23-10-13-6-4-3-5-7-13/h3-9H,10H2,1-2H3