2,4-bis(butylsulfanyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indole

Systemtic Name: 2,4-bis(butylsulfanyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indole Openeye Name: 2,4-bis(butylsulfanyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indole CAS Name: 2,4-bis(butylthio)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indole IUPAC Name: 2,4-bis(butylsulfanyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indole Traditional Name: 2,4-bis(butylthio)-6,7,8,9-tetrahydro-5H-pyrimid[4,5-b]indole Formula: C18H27N3S2 MolecularWeight: 349.55708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC(=NC2=C1C3=C(N2)CCCC3)SCCCC

Isomeric SMILES

CCCCSC1=NC(=NC2=C1C3=C(N2)CCCC3)SCCCC

InChI

InChI=1S/C18H27N3S2/c1-3-5-11-22-17-15-13-9-7-8-10-14(13)19-16(15)20-18(21-17)23-12-6-4-2/h3-12H2,1-2H3,(H,19,20,21)