[7-bromanyl-6-(carbamimidoylsulfanylmethyl)dibenzothiophen-4-yl]methyl carbamimidothioate

Systemtic Name: [7-bromanyl-6-(carbamimidoylsulfanylmethyl)dibenzothiophen-4-yl]methyl carbamimidothioate Openeye Name: 2-[[3-bromo-6-(carbamimidoylsulfanylmethyl)dibenzothiophen-4-yl]methyl]isothiourea CAS Name: carbamimidothioic acid [7-bromo-6-[(carbamimidoylthio)methyl]-4-dibenzothiophenyl]methyl ester IUPAC Name: [7-bromo-6-(carbamimidoylsulfanylmethyl)dibenzothiophen-4-yl]methyl carbamimidothioate Traditional Name: 2-[[6-[(amidinothio)methyl]-3-bromo-dibenzothiophen-4-yl]methyl]isothiourea Formula: C16H15BrN4S3 MolecularWeight: 439.4161

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)CSC(=N)N)SC3=C2C=CC(=C3CSC(=N)N)Br

Isomeric SMILES

C1=CC2=C(C(=C1)CSC(=N)N)SC3=C2C=CC(=C3CSC(=N)N)Br

InChI

InChI=1S/C16H15BrN4S3/c17-12-5-4-10-9-3-1-2-8(6-22-15(18)19)13(9)24-14(10)11(12)7-23-16(20)21/h1-5H,6-7H2,(H3,18,19)(H3,20,21)