2-[2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylethanoylamino]-N-cyclopropyl-benzamide

Systemtic Name: 2-[2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylethanoylamino]-N-cyclopropyl-benzamide Openeye Name: N-cyclopropyl-2-[[2-(4,6-diaminopyrimidin-2-yl)sulfanylacetyl]amino]benzamide CAS Name: N-cyclopropyl-2-[[2-[(4,6-diamino-2-pyrimidinyl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-cyclopropyl-2-[[2-(4,6-diaminopyrimidin-2-yl)sulfanylacetyl]amino]benzamide Traditional Name: N-cyclopropyl-2-[[2-[(4,6-diaminopyrimidin-2-yl)thio]acetyl]amino]benzamide Formula: C16H18N6O2S MolecularWeight: 358.41812

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC=CC=C2NC(=O)CSC3=NC(=CC(=N3)N)N

Isomeric SMILES

C1CC1NC(=O)C2=CC=CC=C2NC(=O)CSC3=NC(=CC(=N3)N)N

InChI

InChI=1S/C16H18N6O2S/c17-12-7-13(18)22-16(21-12)25-8-14(23)20-11-4-2-1-3-10(11)15(24)19-9-5-6-9/h1-4,7,9H,5-6,8H2,(H,19,24)(H,20,23)(H4,17,18,21,22)