2-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanyl]-N-(3-chloranyl-4-methoxy-phenyl)ethanamide

Systemtic Name: 2-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanyl]-N-(3-chloranyl-4-methoxy-phenyl)ethanamide Openeye Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanyl]-N-(3-chloro-4-methoxy-phenyl)acetamide CAS Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylthio]-N-(3-chloro-4-methoxyphenyl)acetamide IUPAC Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanyl]-N-(3-chloro-4-methoxyphenyl)acetamide Traditional Name: 2-[(4-amino-6-anilino-s-triazin-2-yl)methylthio]-N-(3-chloro-4-methoxy-phenyl)acetamide Formula: C19H19ClN6O2S MolecularWeight: 430.91116

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CSCC2=NC(=NC(=N2)NC3=CC=CC=C3)N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CSCC2=NC(=NC(=N2)NC3=CC=CC=C3)N)Cl

InChI

InChI=1S/C19H19ClN6O2S/c1-28-15-8-7-13(9-14(15)20)22-17(27)11-29-10-16-24-18(21)26-19(25-16)23-12-5-3-2-4-6-12/h2-9H,10-11H2,1H3,(H,22,27)(H3,21,23,24,25,26)