2-[2,4-bis(chloranyl)phenoxy]ethanoic acid; N4-ethyl-6-methylsulfanyl-N2-propan-2-yl-1,3,5-triazine-2,4-diamine

Systemtic Name: 2-[2,4-bis(chloranyl)phenoxy]ethanoic acid; N4-ethyl-6-methylsulfanyl-N2-propan-2-yl-1,3,5-triazine-2,4-diamine Openeye Name: 2-(2,4-dichlorophenoxy)acetic acid; N4-ethyl-N2-isopropyl-6-methylsulfanyl-1,3,5-triazine-2,4-diamine CAS Name: 2-(2,4-dichlorophenoxy)acetic acid; N4-ethyl-6-(methylthio)-N2-propan-2-yl-1,3,5-triazine-2,4-diamine IUPAC Name: 2-(2,4-dichlorophenoxy)acetic acid; 4-N-ethyl-6-methylsulfanyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine Traditional Name: 2-(2,4-dichlorophenoxy)acetic acid; ethyl-[4-(isopropylamino)-6-(methylthio)-s-triazin-2-yl]amine Formula: C17H23Cl2N5O3S MolecularWeight: 448.36722

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC(=N1)SC)NC(C)C.C1=CC(=C(C=C1Cl)Cl)OCC(=O)O

Isomeric SMILES

CCNC1=NC(=NC(=N1)SC)NC(C)C.C1=CC(=C(C=C1Cl)Cl)OCC(=O)O

InChI

InChI=1S/C9H17N5S.C8H6Cl2O3/c1-5-10-7-12-8(11-6(2)3)14-9(13-7)15-4;9-5-1-2-7(6(10)3-5)13-4-8(11)12/h6H,5H2,1-4H3,(H2,10,11,12,13,14);1-3H,4H2,(H,11,12)