2-[bis(azanyl)methylideneamino]-N-(6-propyl-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[bis(azanyl)methylideneamino]-N-(6-propyl-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide Openeye Name: 2-guanidino-N-(6-propyl-1,3-benzothiazol-2-yl)thiazole-4-carboxamide CAS Name: 2-(diaminomethylideneamino)-N-(6-propyl-1,3-benzothiazol-2-yl)-4-thiazolecarboxamide IUPAC Name: 2-(diaminomethylideneamino)-N-(6-propyl-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide Traditional Name: 2-guanidino-N-(6-propyl-1,3-benzothiazol-2-yl)thiazole-4-carboxamide Formula: C15H16N6OS2 MolecularWeight: 360.45714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CSC(=N3)N=C(N)N

Isomeric SMILES

CCCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CSC(=N3)N=C(N)N

InChI

InChI=1S/C15H16N6OS2/c1-2-3-8-4-5-9-11(6-8)24-15(18-9)20-12(22)10-7-23-14(19-10)21-13(16)17/h4-7H,2-3H2,1H3,(H,18,20,22)(H4,16,17,19,21)