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

Systemtic Name: 8-methyl-5-phenethyl-3-propan-2-ylsulfanyl-[1,2,4]triazino[5,6-b]indole Openeye Name: 3-isopropylsulfanyl-8-methyl-5-phenethyl-[1,2,4]triazino[5,6-b]indole CAS Name: 8-methyl-5-phenethyl-3-(propan-2-ylthio)-[1,2,4]triazino[5,6-b]indole IUPAC Name: 8-methyl-5-phenethyl-3-propan-2-ylsulfanyl-[1,2,4]triazino[5,6-b]indole Traditional Name: 3-(isopropylthio)-8-methyl-5-phenethyl-[1,2,4]triazin[5,6-b]indole Formula: C21H22N4S MolecularWeight: 362.49118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C3=C2N=NC(=N3)SC(C)C)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)N(C3=C2N=NC(=N3)SC(C)C)CCC4=CC=CC=C4

InChI

InChI=1S/C21H22N4S/c1-14(2)26-21-22-20-19(23-24-21)17-13-15(3)9-10-18(17)25(20)12-11-16-7-5-4-6-8-16/h4-10,13-14H,11-12H2,1-3H3