3-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-(2,3-dihydro-1H-inden-5-yl)propanamide

Systemtic Name: 3-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-(2,3-dihydro-1H-inden-5-yl)propanamide Openeye Name: 3-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-indan-5-yl-propanamide CAS Name: 3-[(4,6-diamino-2-pyrimidinyl)thio]-N-(2,3-dihydro-1H-inden-5-yl)propanamide IUPAC Name: 3-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-(2,3-dihydro-1H-inden-5-yl)propanamide Traditional Name: 3-[(4,6-diaminopyrimidin-2-yl)thio]-N-indan-5-yl-propionamide Formula: C16H19N5OS MolecularWeight: 329.41996

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)NC(=O)CCSC3=NC(=CC(=N3)N)N

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)NC(=O)CCSC3=NC(=CC(=N3)N)N

InChI

InChI=1S/C16H19N5OS/c17-13-9-14(18)21-16(20-13)23-7-6-15(22)19-12-5-4-10-2-1-3-11(10)8-12/h4-5,8-9H,1-3,6-7H2,(H,19,22)(H4,17,18,20,21)