5-(4-tert-butylphenyl)sulfanylquinazoline-2,4,6-triamine

Systemtic Name: 5-(4-tert-butylphenyl)sulfanylquinazoline-2,4,6-triamine Openeye Name: 5-(4-tert-butylphenyl)sulfanylquinazoline-2,4,6-triamine CAS Name: 5-[(4-tert-butylphenyl)thio]quinazoline-2,4,6-triamine IUPAC Name: 5-(4-tert-butylphenyl)sulfanylquinazoline-2,4,6-triamine Traditional Name: [2,4-diamino-5-[(4-tert-butylphenyl)thio]quinazolin-6-yl]amine Formula: C18H21N5S MolecularWeight: 339.45784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SC2=C(C=CC3=C2C(=NC(=N3)N)N)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SC2=C(C=CC3=C2C(=NC(=N3)N)N)N

InChI

InChI=1S/C18H21N5S/c1-18(2,3)10-4-6-11(7-5-10)24-15-12(19)8-9-13-14(15)16(20)23-17(21)22-13/h4-9H,19H2,1-3H3,(H4,20,21,22,23)