N4-(4-pyridin-4-ylsulfanylphenyl)-5,6,7,8-tetrahydroquinazoline-2,4-diamine

Systemtic Name: N4-(4-pyridin-4-ylsulfanylphenyl)-5,6,7,8-tetrahydroquinazoline-2,4-diamine Openeye Name: N4-[4-(4-pyridylsulfanyl)phenyl]-5,6,7,8-tetrahydroquinazoline-2,4-diamine CAS Name: N4-[4-(pyridin-4-ylthio)phenyl]-5,6,7,8-tetrahydroquinazoline-2,4-diamine IUPAC Name: 4-N-(4-pyridin-4-ylsulfanylphenyl)-5,6,7,8-tetrahydroquinazoline-2,4-diamine Traditional Name: (2-amino-5,6,7,8-tetrahydroquinazolin-4-yl)-[4-(4-pyridylthio)phenyl]amine Formula: C19H19N5S MolecularWeight: 349.45266

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=NC(=N2)N)NC3=CC=C(C=C3)SC4=CC=NC=C4

Isomeric SMILES

C1CCC2=C(C1)C(=NC(=N2)N)NC3=CC=C(C=C3)SC4=CC=NC=C4

InChI

InChI=1S/C19H19N5S/c20-19-23-17-4-2-1-3-16(17)18(24-19)22-13-5-7-14(8-6-13)25-15-9-11-21-12-10-15/h5-12H,1-4H2,(H3,20,22,23,24)