2-[[5-(hydroxymethyl)-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-[[5-(hydroxymethyl)-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[[5-(hydroxymethyl)-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[[5-(hydroxymethyl)-[1,2,4]triazino[5,6-b]indol-3-yl]thio]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[[5-(hydroxymethyl)-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[(5-methylol-[1,2,4]triazin[5,6-b]indol-3-yl)thio]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide Formula: C19H18N6O2S2 MolecularWeight: 426.51522

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(S2)NC(=O)CSC3=NC4=C(C5=CC=CC=C5N4CO)N=N3

Isomeric SMILES

C1CCC2=C(C1)N=C(S2)NC(=O)CSC3=NC4=C(C5=CC=CC=C5N4CO)N=N3

InChI

InChI=1S/C19H18N6O2S2/c26-10-25-13-7-3-1-5-11(13)16-17(25)22-19(24-23-16)28-9-15(27)21-18-20-12-6-2-4-8-14(12)29-18/h1,3,5,7,26H,2,4,6,8-10H2,(H,20,21,27)