N'-[2-(3-imidazol-1-ylpropylamino)-1,3-benzothiazol-6-yl]thiophene-2-carboximidamide

Systemtic Name: N'-[2-(3-imidazol-1-ylpropylamino)-1,3-benzothiazol-6-yl]thiophene-2-carboximidamide Openeye Name: N'-[2-(3-imidazol-1-ylpropylamino)-1,3-benzothiazol-6-yl]thiophene-2-carboxamidine CAS Name: N'-[2-[3-(1-imidazolyl)propylamino]-1,3-benzothiazol-6-yl]-2-thiophenecarboximidamide IUPAC Name: N'-[2-(3-imidazol-1-ylpropylamino)-1,3-benzothiazol-6-yl]thiophene-2-carboximidamide Traditional Name: N'-[2-(3-imidazol-1-ylpropylamino)-1,3-benzothiazol-6-yl]thiophene-2-carboxamidine Formula: C18H18N6S2 MolecularWeight: 382.50572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=NC2=CC3=C(C=C2)N=C(S3)NCCCN4C=CN=C4)N

Isomeric SMILES

C1=CSC(=C1)C(=NC2=CC3=C(C=C2)N=C(S3)NCCCN4C=CN=C4)N

InChI

InChI=1S/C18H18N6S2/c19-17(15-3-1-10-25-15)22-13-4-5-14-16(11-13)26-18(23-14)21-6-2-8-24-9-7-20-12-24/h1,3-5,7,9-12H,2,6,8H2,(H2,19,22)(H,21,23)