N-[3-(aminomethyl)phenyl]-4-(3-methoxyphenyl)sulfanyl-pyrimidin-2-amine

Systemtic Name: N-[3-(aminomethyl)phenyl]-4-(3-methoxyphenyl)sulfanyl-pyrimidin-2-amine Openeye Name: N-[3-(aminomethyl)phenyl]-4-(3-methoxyphenyl)sulfanyl-pyrimidin-2-amine CAS Name: N-[3-(aminomethyl)phenyl]-4-[(3-methoxyphenyl)thio]-2-pyrimidinamine IUPAC Name: N-[3-(aminomethyl)phenyl]-4-(3-methoxyphenyl)sulfanylpyrimidin-2-amine Traditional Name: [3-(aminomethyl)phenyl]-[4-[(3-methoxyphenyl)thio]pyrimidin-2-yl]amine Formula: C18H18N4OS MolecularWeight: 338.42672

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)SC2=NC(=NC=C2)NC3=CC=CC(=C3)CN

Isomeric SMILES

COC1=CC(=CC=C1)SC2=NC(=NC=C2)NC3=CC=CC(=C3)CN

InChI

InChI=1S/C18H18N4OS/c1-23-15-6-3-7-16(11-15)24-17-8-9-20-18(22-17)21-14-5-2-4-13(10-14)12-19/h2-11H,12,19H2,1H3,(H,20,21,22)