4-[4-(1,3-benzothiazol-6-ylamino)-6-(2-phenylpropylamino)-1,3,5-triazin-2-yl]piperazine-1-carboximidamide

Systemtic Name: 4-[4-(1,3-benzothiazol-6-ylamino)-6-(2-phenylpropylamino)-1,3,5-triazin-2-yl]piperazine-1-carboximidamide Openeye Name: 4-[4-(1,3-benzothiazol-6-ylamino)-6-(2-phenylpropylamino)-1,3,5-triazin-2-yl]piperazine-1-carboxamidine CAS Name: 4-[4-(1,3-benzothiazol-6-ylamino)-6-(2-phenylpropylamino)-1,3,5-triazin-2-yl]-1-piperazinecarboximidamide IUPAC Name: 4-[4-(1,3-benzothiazol-6-ylamino)-6-(2-phenylpropylamino)-1,3,5-triazin-2-yl]piperazine-1-carboximidamide Traditional Name: 4-[4-(1,3-benzothiazol-6-ylamino)-6-(2-phenylpropylamino)-s-triazin-2-yl]piperazine-1-carboxamidine Formula: C24H28N10S MolecularWeight: 488.61112

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=NC(=NC(=N1)NC2=CC3=C(C=C2)N=CS3)N4CCN(CC4)C(=N)N)C5=CC=CC=C5

Isomeric SMILES

CC(CNC1=NC(=NC(=N1)NC2=CC3=C(C=C2)N=CS3)N4CCN(CC4)C(=N)N)C5=CC=CC=C5

InChI

InChI=1S/C24H28N10S/c1-16(17-5-3-2-4-6-17)14-27-22-30-23(29-18-7-8-19-20(13-18)35-15-28-19)32-24(31-22)34-11-9-33(10-12-34)21(25)26/h2-8,13,15-16H,9-12,14H2,1H3,(H3,25,26)(H2,27,29,30,31,32)