N3-[4-(1,2-benzoxazol-3-yl)pyrimidin-2-yl]-4-methyl-benzene-1,3-diamine

Systemtic Name: N3-[4-(1,2-benzoxazol-3-yl)pyrimidin-2-yl]-4-methyl-benzene-1,3-diamine Openeye Name: N3-[4-(1,2-benzoxazol-3-yl)pyrimidin-2-yl]-4-methyl-benzene-1,3-diamine CAS Name: N3-[4-(1,2-benzoxazol-3-yl)-2-pyrimidinyl]-4-methylbenzene-1,3-diamine IUPAC Name: 3-N-[4-(1,2-benzoxazol-3-yl)pyrimidin-2-yl]-4-methylbenzene-1,3-diamine Traditional Name: (5-amino-2-methyl-phenyl)-(4-indoxazen-3-ylpyrimidin-2-yl)amine Formula: C18H15N5O MolecularWeight: 317.3446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N)NC2=NC=CC(=N2)C3=NOC4=CC=CC=C43

Isomeric SMILES

CC1=C(C=C(C=C1)N)NC2=NC=CC(=N2)C3=NOC4=CC=CC=C43

InChI

InChI=1S/C18H15N5O/c1-11-6-7-12(19)10-15(11)22-18-20-9-8-14(21-18)17-13-4-2-3-5-16(13)24-23-17/h2-10H,19H2,1H3,(H,20,21,22)