1-[3-chloranyl-4-(phenylsulfanylmethyl)phenyl]-6,6-dimethyl-1,3,5-triazine-2,4-diamine

Systemtic Name: 1-[3-chloranyl-4-(phenylsulfanylmethyl)phenyl]-6,6-dimethyl-1,3,5-triazine-2,4-diamine Openeye Name: 1-[3-chloro-4-(phenylsulfanylmethyl)phenyl]-6,6-dimethyl-1,3,5-triazine-2,4-diamine CAS Name: 1-[3-chloro-4-[(phenylthio)methyl]phenyl]-6,6-dimethyl-1,3,5-triazine-2,4-diamine IUPAC Name: 1-[3-chloro-4-(phenylsulfanylmethyl)phenyl]-6,6-dimethyl-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-1-[3-chloro-4-[(phenylthio)methyl]phenyl]-6,6-dimethyl-s-triazin-2-yl]amine Formula: C18H20ClN5S MolecularWeight: 373.9029

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Descriptors Computed from Structure

Canonical SMILES:

CC1(N=C(N=C(N1C2=CC(=C(C=C2)CSC3=CC=CC=C3)Cl)N)N)C

Isomeric SMILES

CC1(N=C(N=C(N1C2=CC(=C(C=C2)CSC3=CC=CC=C3)Cl)N)N)C

InChI

InChI=1S/C18H20ClN5S/c1-18(2)23-16(20)22-17(21)24(18)13-9-8-12(15(19)10-13)11-25-14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H4,20,21,22,23)