5-(1,3-benzothiazol-2-yl)-N4-phenyl-pyrimidine-2,4,6-triamine

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-N4-phenyl-pyrimidine-2,4,6-triamine Openeye Name: 5-(1,3-benzothiazol-2-yl)-N4-phenyl-pyrimidine-2,4,6-triamine CAS Name: 5-(1,3-benzothiazol-2-yl)-N4-phenylpyrimidine-2,4,6-triamine IUPAC Name: 5-(1,3-benzothiazol-2-yl)-4-N-phenylpyrimidine-2,4,6-triamine Traditional Name: [2,6-diamino-5-(1,3-benzothiazol-2-yl)pyrimidin-4-yl]-phenyl-amine Formula: C17H14N6S MolecularWeight: 334.39826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=C2C3=NC4=CC=CC=C4S3)N)N

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=C2C3=NC4=CC=CC=C4S3)N)N

InChI

InChI=1S/C17H14N6S/c18-14-13(16-21-11-8-4-5-9-12(11)24-16)15(23-17(19)22-14)20-10-6-2-1-3-7-10/h1-9H,(H5,18,19,20,22,23)