6-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanylmethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanylmethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(5-chloro-1,3-benzothiazol-2-yl)sulfanylmethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine CAS Name: 6-[[(5-chloro-1,3-benzothiazol-2-yl)thio]methyl]-N2-phenyl-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(5-chloro-1,3-benzothiazol-2-yl)sulfanylmethyl]-2-N-phenyl-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(5-chloro-1,3-benzothiazol-2-yl)thio]methyl]-s-triazin-2-yl]-phenyl-amine Formula: C17H13ClN6S2 MolecularWeight: 400.90832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSC3=NC4=C(S3)C=CC(=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSC3=NC4=C(S3)C=CC(=C4)Cl

InChI

InChI=1S/C17H13ClN6S2/c18-10-6-7-13-12(8-10)21-17(26-13)25-9-14-22-15(19)24-16(23-14)20-11-4-2-1-3-5-11/h1-8H,9H2,(H3,19,20,22,23,24)