8-methyl-5-(phenylmethyl)-3-propylsulfanyl-[1,2,4]triazino[5,6-b]indole

Systemtic Name: 8-methyl-5-(phenylmethyl)-3-propylsulfanyl-[1,2,4]triazino[5,6-b]indole Openeye Name: 5-benzyl-8-methyl-3-propylsulfanyl-[1,2,4]triazino[5,6-b]indole CAS Name: 8-methyl-5-(phenylmethyl)-3-(propylthio)-[1,2,4]triazino[5,6-b]indole IUPAC Name: 5-benzyl-8-methyl-3-propylsulfanyl-[1,2,4]triazino[5,6-b]indole Traditional Name: 5-benzyl-8-methyl-3-(propylthio)-[1,2,4]triazin[5,6-b]indole Formula: C20H20N4S MolecularWeight: 348.4646

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC2=C(C3=C(N2CC4=CC=CC=C4)C=CC(=C3)C)N=N1

Isomeric SMILES

CCCSC1=NC2=C(C3=C(N2CC4=CC=CC=C4)C=CC(=C3)C)N=N1

InChI

InChI=1S/C20H20N4S/c1-3-11-25-20-21-19-18(22-23-20)16-12-14(2)9-10-17(16)24(19)13-15-7-5-4-6-8-15/h4-10,12H,3,11,13H2,1-2H3