(2R)-2-[(5-methyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)butanamide

Systemtic Name: (2R)-2-[(5-methyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)butanamide Openeye Name: (2R)-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-2-[(5-methyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamide CAS Name: (2R)-2-[(5-methyl-[1,2,4]triazino[5,6-b]indol-3-yl)thio]-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)butanamide IUPAC Name: (2R)-2-[(5-methyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)butanamide Traditional Name: (2R)-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-2-[(5-methyl-[1,2,4]triazin[5,6-b]indol-3-yl)thio]butyramide Formula: C19H21N7OS2 MolecularWeight: 427.54634

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NN=C(S1)C(C)C)SC2=NC3=C(C4=CC=CC=C4N3C)N=N2

Isomeric SMILES

CC[C@H](C(=O)NC1=NN=C(S1)C(C)C)SC2=NC3=C(C4=CC=CC=C4N3C)N=N2

InChI

InChI=1S/C19H21N7OS2/c1-5-13(16(27)21-19-25-23-17(29-19)10(2)3)28-18-20-15-14(22-24-18)11-8-6-7-9-12(11)26(15)4/h6-10,13H,5H2,1-4H3,(H,21,25,27)/t13-/m1/s1