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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C3=C2N=NC(=N3)SC(C)C)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)N(C3=C2N=NC(=N3)SC(C)C)CC4=CC=CC=C4

InChI

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